2-[2-[(1-methyl-9H-pyrido[3,4-b]indol-3-yl)carbonylamino]propanoylamino]-2-phenyl-ethanoic acid

Systemtic Name: 2-[2-[(1-methyl-9H-pyrido[3,4-b]indol-3-yl)carbonylamino]propanoylamino]-2-phenyl-ethanoic acid Openeye Name: 2-[2-[(1-methyl-9H-pyrido[3,4-b]indole-3-carbonyl)amino]propanoylamino]-2-phenyl-acetic acid CAS Name: 2-[[2-[[(1-methyl-9H-pyrido[3,4-b]indol-3-yl)-oxomethyl]amino]-1-oxopropyl]amino]-2-phenylacetic acid IUPAC Name: 2-[2-[(1-methyl-9H-pyrido[3,4-b]indole-3-carbonyl)amino]propanoylamino]-2-phenylacetic acid Traditional Name: 2-[2-[(1-methyl-9H-$b-carboline-3-carbonyl)amino]propanoylamino]-2-phenyl-acetic acid Formula: C24H22N4O4 MolecularWeight: 430.45588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=N1)C(=O)NC(C)C(=O)NC(C3=CC=CC=C3)C(=O)O)C4=CC=CC=C4N2

Isomeric SMILES

CC1=C2C(=CC(=N1)C(=O)NC(C)C(=O)NC(C3=CC=CC=C3)C(=O)O)C4=CC=CC=C4N2

InChI

InChI=1S/C24H22N4O4/c1-13-20-17(16-10-6-7-11-18(16)27-20)12-19(25-13)23(30)26-14(2)22(29)28-21(24(31)32)15-8-4-3-5-9-15/h3-12,14,21,27H,1-2H3,(H,26,30)(H,28,29)(H,31,32)