methyl 4-acetyloxy-8-(chloromethyl)-2-methyl-6-[(E)-3-[1-methyl-4-[[1-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrol-2-yl]carbonylamino]pyrrol-2-yl]prop-2-enoyl]-7,8-dihydro-3H-pyrrolo[3,2-e]indole-1-carboxylate

Systemtic Name: methyl 4-acetyloxy-8-(chloromethyl)-2-methyl-6-[(E)-3-[1-methyl-4-[[1-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrol-2-yl]carbonylamino]pyrrol-2-yl]prop-2-enoyl]-7,8-dihydro-3H-pyrrolo[3,2-e]indole-1-carboxylate Openeye Name: methyl 4-acetoxy-6-[(E)-3-[4-[[4-(tert-butoxycarbonylamino)-1-methyl-pyrrole-2-carbonyl]amino]-1-methyl-pyrrol-2-yl]prop-2-enoyl]-8-(chloromethyl)-2-methyl-7,8-dihydro-3H-pyrrolo[3,2-e]indole-1-carboxylate CAS Name: 4-acetyloxy-8-(chloromethyl)-2-methyl-6-[(E)-3-[1-methyl-4-[[[1-methyl-4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-pyrrolyl]-oxomethyl]amino]-2-pyrrolyl]-1-oxoprop-2-enyl]-7,8-dihydro-3H-pyrrolo[3,2-e]indole-1-carboxylic acid methyl ester IUPAC Name: methyl 4-acetyloxy-8-(chloromethyl)-2-methyl-6-[(E)-3-[1-methyl-4-[[1-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrole-2-carbonyl]amino]pyrrol-2-yl]prop-2-enoyl]-7,8-dihydro-3H-pyrrolo[3,2-e]indole-1-carboxylate Traditional Name: 4-acetoxy-6-[(E)-3-[4-[[4-(tert-butoxycarbonylamino)-1-methyl-pyrrole-2-carbonyl]amino]-1-methyl-pyrrol-2-yl]acryloyl]-8-(chloromethyl)-2-methyl-7,8-dihydro-3H-pyrrol[3,2-e]indole-1-carboxylic acid methyl ester Formula: C35H39ClN6O8 MolecularWeight: 707.17256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C3C(CN(C3=CC(=C2N1)OC(=O)C)C(=O)C=CC4=CC(=CN4C)NC(=O)C5=CC(=CN5C)NC(=O)OC(C)(C)C)CCl)C(=O)OC

Isomeric SMILES

CC1=C(C2=C3C(CN(C3=CC(=C2N1)OC(=O)C)C(=O)/C=C/C4=CC(=CN4C)NC(=O)C5=CC(=CN5C)NC(=O)OC(C)(C)C)CCl)C(=O)OC

InChI

InChI=1S/C35H39ClN6O8/c1-18-28(33(46)48-8)30-29-20(14-36)15-42(24(29)13-26(31(30)37-18)49-19(2)43)27(44)10-9-23-11-21(16-40(23)6)38-32(45)25-12-22(17-41(25)7)39-34(47)50-35(3,4)5/h9-13,16-17,20,37H,14-15H2,1-8H3,(H,38,45)(H,39,47)/b10-9+