ethyl 4-azanyl-5-(1H-indol-3-yl)-2-[1H-indol-2-ylcarbonyl-(phenylmethyl)amino]-3-oxidanylidene-pentanoate

Systemtic Name: ethyl 4-azanyl-5-(1H-indol-3-yl)-2-[1H-indol-2-ylcarbonyl-(phenylmethyl)amino]-3-oxidanylidene-pentanoate Openeye Name: ethyl 4-amino-2-[benzyl(1H-indole-2-carbonyl)amino]-5-(1H-indol-3-yl)-3-oxo-pentanoate CAS Name: 4-amino-5-(1H-indol-3-yl)-2-[[1H-indol-2-yl(oxo)methyl]-(phenylmethyl)amino]-3-oxopentanoic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[benzyl(1H-indole-2-carbonyl)amino]-5-(1H-indol-3-yl)-3-oxopentanoate Traditional Name: 4-amino-2-[benzyl(1H-indole-2-carbonyl)amino]-5-(1H-indol-3-yl)-3-keto-valeric acid ethyl ester Formula: C31H30N4O4 MolecularWeight: 522.5943

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)C(CC1=CNC2=CC=CC=C21)N)N(CC3=CC=CC=C3)C(=O)C4=CC5=CC=CC=C5N4

Isomeric SMILES

CCOC(=O)C(C(=O)C(CC1=CNC2=CC=CC=C21)N)N(CC3=CC=CC=C3)C(=O)C4=CC5=CC=CC=C5N4

InChI

InChI=1S/C31H30N4O4/c1-2-39-31(38)28(29(36)24(32)16-22-18-33-26-15-9-7-13-23(22)26)35(19-20-10-4-3-5-11-20)30(37)27-17-21-12-6-8-14-25(21)34-27/h3-15,17-18,24,28,33-34H,2,16,19,32H2,1H3