ethyl 4-chloranyl-1-methyl-7-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propoxy]indole-2-carboxylate

Systemtic Name: ethyl 4-chloranyl-1-methyl-7-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propoxy]indole-2-carboxylate Openeye Name: ethyl 7-[3-(tert-butoxycarbonylamino)propoxy]-4-chloro-1-methyl-indole-2-carboxylate CAS Name: 4-chloro-1-methyl-7-[3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propoxy]-2-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-chloro-1-methyl-7-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propoxy]indole-2-carboxylate Traditional Name: 7-[3-(tert-butoxycarbonylamino)propoxy]-4-chloro-1-methyl-indole-2-carboxylic acid ethyl ester Formula: C20H27ClN2O5 MolecularWeight: 410.89178

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=CC(=C2N1C)OCCCNC(=O)OC(C)(C)C)Cl

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=CC(=C2N1C)OCCCNC(=O)OC(C)(C)C)Cl

InChI

InChI=1S/C20H27ClN2O5/c1-6-26-18(24)15-12-13-14(21)8-9-16(17(13)23(15)5)27-11-7-10-22-19(25)28-20(2,3)4/h8-9,12H,6-7,10-11H2,1-5H3,(H,22,25)