5-azanyl-2-[[1-(2-methylphenyl)-9H-pyrido[3,4-b]indol-3-yl]carbonylamino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-azanyl-2-[[1-(2-methylphenyl)-9H-pyrido[3,4-b]indol-3-yl]carbonylamino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-amino-2-[[1-(o-tolyl)-9H-pyrido[3,4-b]indole-3-carbonyl]amino]-5-oxo-pentanoic acid CAS Name: 5-amino-2-[[[1-(2-methylphenyl)-9H-pyrido[3,4-b]indol-3-yl]-oxomethyl]amino]-5-oxopentanoic acid IUPAC Name: 5-amino-2-[[1-(2-methylphenyl)-9H-pyrido[3,4-b]indole-3-carbonyl]amino]-5-oxopentanoic acid Traditional Name: 5-amino-5-keto-2-[[1-(o-tolyl)-9H-$b-carboline-3-carbonyl]amino]valeric acid Formula: C24H22N4O4 MolecularWeight: 430.45588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=C3C(=CC(=N2)C(=O)NC(CCC(=O)N)C(=O)O)C4=CC=CC=C4N3

Isomeric SMILES

CC1=CC=CC=C1C2=C3C(=CC(=N2)C(=O)NC(CCC(=O)N)C(=O)O)C4=CC=CC=C4N3

InChI

InChI=1S/C24H22N4O4/c1-13-6-2-3-7-14(13)21-22-16(15-8-4-5-9-17(15)26-22)12-19(27-21)23(30)28-18(24(31)32)10-11-20(25)29/h2-9,12,18,26H,10-11H2,1H3,(H2,25,29)(H,28,30)(H,31,32)