2-[[2-(1H-indol-3-yl)-2-oxidanylidene-ethanoyl]amino]-3-(6-nitro-1H-indol-3-yl)propanoic acid

Systemtic Name: 2-[[2-(1H-indol-3-yl)-2-oxidanylidene-ethanoyl]amino]-3-(6-nitro-1H-indol-3-yl)propanoic acid Openeye Name: 2-[[2-(1H-indol-3-yl)-2-oxo-acetyl]amino]-3-(6-nitro-1H-indol-3-yl)propanoic acid CAS Name: 2-[[2-(1H-indol-3-yl)-1,2-dioxoethyl]amino]-3-(6-nitro-1H-indol-3-yl)propanoic acid IUPAC Name: 2-[[2-(1H-indol-3-yl)-2-oxoacetyl]amino]-3-(6-nitro-1H-indol-3-yl)propanoic acid Traditional Name: 2-[[2-(1H-indol-3-yl)-2-keto-acetyl]amino]-3-(6-nitro-1H-indol-3-yl)propionic acid Formula: C21H16N4O6 MolecularWeight: 420.37494

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)C(=O)C(=O)NC(CC3=CNC4=C3C=CC(=C4)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)C(=O)C(=O)NC(CC3=CNC4=C3C=CC(=C4)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C21H16N4O6/c26-19(15-10-23-16-4-2-1-3-14(15)16)20(27)24-18(21(28)29)7-11-9-22-17-8-12(25(30)31)5-6-13(11)17/h1-6,8-10,18,22-23H,7H2,(H,24,27)(H,28,29)