(2S)-5-azanyl-5-oxidanylidene-2-(9H-pyrido[3,4-b]indol-3-ylcarbonylamino)pentanoic acid

Systemtic Name: (2S)-5-azanyl-5-oxidanylidene-2-(9H-pyrido[3,4-b]indol-3-ylcarbonylamino)pentanoic acid Openeye Name: (2S)-5-amino-5-oxo-2-(9H-pyrido[3,4-b]indole-3-carbonylamino)pentanoic acid CAS Name: (2S)-5-amino-5-oxo-2-[[oxo(9H-pyrido[3,4-b]indol-3-yl)methyl]amino]pentanoic acid IUPAC Name: (2S)-5-amino-5-oxo-2-(9H-pyrido[3,4-b]indole-3-carbonylamino)pentanoic acid Traditional Name: (2S)-5-amino-2-(9H-$b-carboline-3-carbonylamino)-5-keto-valeric acid Formula: C17H16N4O4 MolecularWeight: 340.33334

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=CC(=NC=C3N2)C(=O)NC(CCC(=O)N)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C3=CC(=NC=C3N2)C(=O)N[C@@H](CCC(=O)N)C(=O)O

InChI

InChI=1S/C17H16N4O4/c18-15(22)6-5-12(17(24)25)21-16(23)13-7-10-9-3-1-2-4-11(9)20-14(10)8-19-13/h1-4,7-8,12,20H,5-6H2,(H2,18,22)(H,21,23)(H,24,25)/t12-/m0/s1