2-[(1-methyl-9H-pyrido[3,4-b]indol-3-yl)carbonylamino]-3-oxidanyl-butanoic acid

Systemtic Name: 2-[(1-methyl-9H-pyrido[3,4-b]indol-3-yl)carbonylamino]-3-oxidanyl-butanoic acid Openeye Name: 3-hydroxy-2-[(1-methyl-9H-pyrido[3,4-b]indole-3-carbonyl)amino]butanoic acid CAS Name: 3-hydroxy-2-[[(1-methyl-9H-pyrido[3,4-b]indol-3-yl)-oxomethyl]amino]butanoic acid IUPAC Name: 3-hydroxy-2-[(1-methyl-9H-pyrido[3,4-b]indole-3-carbonyl)amino]butanoic acid Traditional Name: 3-hydroxy-2-[(1-methyl-9H-$b-carboline-3-carbonyl)amino]butyric acid Formula: C17H17N3O4 MolecularWeight: 327.33458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=N1)C(=O)NC(C(C)O)C(=O)O)C3=CC=CC=C3N2

Isomeric SMILES

CC1=C2C(=CC(=N1)C(=O)NC(C(C)O)C(=O)O)C3=CC=CC=C3N2

InChI

InChI=1S/C17H17N3O4/c1-8-14-11(10-5-3-4-6-12(10)19-14)7-13(18-8)16(22)20-15(9(2)21)17(23)24/h3-7,9,15,19,21H,1-2H3,(H,20,22)(H,23,24)