ethyl 2-[1H-indol-3-ylmethyl-[(2S)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]amino]ethanoate

Systemtic Name: ethyl 2-[1H-indol-3-ylmethyl-[(2S)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]amino]ethanoate Openeye Name: ethyl 2-[[(2S)-2-(tert-butoxycarbonylamino)-3-methyl-butanoyl]-(1H-indol-3-ylmethyl)amino]acetate CAS Name: 2-[1H-indol-3-ylmethyl-[(2S)-3-methyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxobutyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[1H-indol-3-ylmethyl-[(2S)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]amino]acetate Traditional Name: 2-[[(2S)-2-(tert-butoxycarbonylamino)-3-methyl-butanoyl]-(1H-indol-3-ylmethyl)amino]acetic acid ethyl ester Formula: C23H33N3O5 MolecularWeight: 431.52522

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(CC1=CNC2=CC=CC=C21)C(=O)C(C(C)C)NC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)CN(CC1=CNC2=CC=CC=C21)C(=O)[C@H](C(C)C)NC(=O)OC(C)(C)C

InChI

InChI=1S/C23H33N3O5/c1-7-30-19(27)14-26(13-16-12-24-18-11-9-8-10-17(16)18)21(28)20(15(2)3)25-22(29)31-23(4,5)6/h8-12,15,20,24H,7,13-14H2,1-6H3,(H,25,29)/t20-/m0/s1