1-[2-[[2-azanyl-3-(1H-indol-3-yl)propanoyl]amino]-3-phenyl-propanoyl]-3-oxidanylidene-aziridine-2-carboxylic acid

Systemtic Name: 1-[2-[[2-azanyl-3-(1H-indol-3-yl)propanoyl]amino]-3-phenyl-propanoyl]-3-oxidanylidene-aziridine-2-carboxylic acid Openeye Name: 1-[2-[[2-amino-3-(1H-indol-3-yl)propanoyl]amino]-3-phenyl-propanoyl]-3-oxo-aziridine-2-carboxylic acid CAS Name: 1-[2-[[2-amino-3-(1H-indol-3-yl)-1-oxopropyl]amino]-1-oxo-3-phenylpropyl]-3-oxo-2-aziridinecarboxylic acid IUPAC Name: 1-[2-[[2-amino-3-(1H-indol-3-yl)propanoyl]amino]-3-phenylpropanoyl]-3-oxoaziridine-2-carboxylic acid Traditional Name: 1-[2-[[2-amino-3-(1H-indol-3-yl)propanoyl]amino]-3-phenyl-propanoyl]-3-keto-ethylenimine-2-carboxylic acid Formula: C23H22N4O5 MolecularWeight: 434.44458

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)N2C(C2=O)C(=O)O)NC(=O)C(CC3=CNC4=CC=CC=C43)N

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)N2C(C2=O)C(=O)O)NC(=O)C(CC3=CNC4=CC=CC=C43)N

InChI

InChI=1S/C23H22N4O5/c24-16(11-14-12-25-17-9-5-4-8-15(14)17)20(28)26-18(10-13-6-2-1-3-7-13)21(29)27-19(22(27)30)23(31)32/h1-9,12,16,18-19,25H,10-11,24H2,(H,26,28)(H,31,32)