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

Systemtic Name: 5-azanyl-5-oxidanylidene-2-[(1-phenethyl-9H-pyrido[3,4-b]indol-3-yl)carbonylamino]pentanoic acid Openeye Name: 5-amino-5-oxo-2-[(1-phenethyl-9H-pyrido[3,4-b]indole-3-carbonyl)amino]pentanoic acid CAS Name: 5-amino-5-oxo-2-[[oxo-(1-phenethyl-9H-pyrido[3,4-b]indol-3-yl)methyl]amino]pentanoic acid IUPAC Name: 5-amino-5-oxo-2-[(1-phenethyl-9H-pyrido[3,4-b]indole-3-carbonyl)amino]pentanoic acid Traditional Name: 5-amino-5-keto-2-[(1-phenethyl-9H-$b-carboline-3-carbonyl)amino]valeric acid Formula: C25H24N4O4 MolecularWeight: 444.48246

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=C3C(=CC(=N2)C(=O)NC(CCC(=O)N)C(=O)O)C4=CC=CC=C4N3

Isomeric SMILES

C1=CC=C(C=C1)CCC2=C3C(=CC(=N2)C(=O)NC(CCC(=O)N)C(=O)O)C4=CC=CC=C4N3

InChI

InChI=1S/C25H24N4O4/c26-22(30)13-12-20(25(32)33)29-24(31)21-14-17-16-8-4-5-9-18(16)28-23(17)19(27-21)11-10-15-6-2-1-3-7-15/h1-9,14,20,28H,10-13H2,(H2,26,30)(H,29,31)(H,32,33)