methyl 2-[[1-(4-acetamidophenyl)sulfonyl-2,3-dihydroindol-2-yl]carbonyl-phenylmethoxycarbonyl-amino]-6-azanyl-hexanoate

Systemtic Name: methyl 2-[[1-(4-acetamidophenyl)sulfonyl-2,3-dihydroindol-2-yl]carbonyl-phenylmethoxycarbonyl-amino]-6-azanyl-hexanoate Openeye Name: methyl 2-[[1-(4-acetamidophenyl)sulfonylindoline-2-carbonyl]-benzyloxycarbonyl-amino]-6-amino-hexanoate CAS Name: 2-[[[1-(4-acetamidophenyl)sulfonyl-2,3-dihydroindol-2-yl]-oxomethyl]-phenylmethoxycarbonylamino]-6-aminohexanoic acid methyl ester IUPAC Name: methyl 2-[[1-(4-acetamidophenyl)sulfonyl-2,3-dihydroindole-2-carbonyl]-phenylmethoxycarbonylamino]-6-aminohexanoate Traditional Name: 2-[[1-(4-acetamidophenyl)sulfonylindoline-2-carbonyl]-carbobenzoxy-amino]-6-amino-hexanoic acid methyl ester Formula: C32H36N4O8S MolecularWeight: 636.71524

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2C(CC3=CC=CC=C32)C(=O)N(C(CCCCN)C(=O)OC)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2C(CC3=CC=CC=C32)C(=O)N(C(CCCCN)C(=O)OC)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C32H36N4O8S/c1-22(37)34-25-15-17-26(18-16-25)45(41,42)36-27-13-7-6-12-24(27)20-29(36)30(38)35(28(31(39)43-2)14-8-9-19-33)32(40)44-21-23-10-4-3-5-11-23/h3-7,10-13,15-18,28-29H,8-9,14,19-21,33H2,1-2H3,(H,34,37)