4-azanyl-4-oxidanylidene-2-[(1-phenyl-9H-pyrido[3,4-b]indol-3-yl)carbonylamino]butanoic acid

Systemtic Name: 4-azanyl-4-oxidanylidene-2-[(1-phenyl-9H-pyrido[3,4-b]indol-3-yl)carbonylamino]butanoic acid Openeye Name: 4-amino-4-oxo-2-[(1-phenyl-9H-pyrido[3,4-b]indole-3-carbonyl)amino]butanoic acid CAS Name: 4-amino-4-oxo-2-[[oxo-(1-phenyl-9H-pyrido[3,4-b]indol-3-yl)methyl]amino]butanoic acid IUPAC Name: 4-amino-4-oxo-2-[(1-phenyl-9H-pyrido[3,4-b]indole-3-carbonyl)amino]butanoic acid Traditional Name: 4-amino-4-keto-2-[(1-phenyl-9H-$b-carboline-3-carbonyl)amino]butyric acid Formula: C22H18N4O4 MolecularWeight: 402.40272

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C(=CC(=N2)C(=O)NC(CC(=O)N)C(=O)O)C4=CC=CC=C4N3

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C(=CC(=N2)C(=O)NC(CC(=O)N)C(=O)O)C4=CC=CC=C4N3

InChI

InChI=1S/C22H18N4O4/c23-18(27)11-17(22(29)30)26-21(28)16-10-14-13-8-4-5-9-15(13)24-20(14)19(25-16)12-6-2-1-3-7-12/h1-10,17,24H,11H2,(H2,23,27)(H,26,28)(H,29,30)