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

Systemtic Name: 3-oxidanyl-2-[(1-phenethyl-9H-pyrido[3,4-b]indol-3-yl)carbonylamino]butanoic acid Openeye Name: 3-hydroxy-2-[(1-phenethyl-9H-pyrido[3,4-b]indole-3-carbonyl)amino]butanoic acid CAS Name: 3-hydroxy-2-[[oxo-(1-phenethyl-9H-pyrido[3,4-b]indol-3-yl)methyl]amino]butanoic acid IUPAC Name: 3-hydroxy-2-[(1-phenethyl-9H-pyrido[3,4-b]indole-3-carbonyl)amino]butanoic acid Traditional Name: 3-hydroxy-2-[(1-phenethyl-9H-$b-carboline-3-carbonyl)amino]butyric acid Formula: C24H23N3O4 MolecularWeight: 417.45712

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)O)NC(=O)C1=NC(=C2C(=C1)C3=CC=CC=C3N2)CCC4=CC=CC=C4)O

Isomeric SMILES

CC(C(C(=O)O)NC(=O)C1=NC(=C2C(=C1)C3=CC=CC=C3N2)CCC4=CC=CC=C4)O

InChI

InChI=1S/C24H23N3O4/c1-14(28)21(24(30)31)27-23(29)20-13-17-16-9-5-6-10-18(16)26-22(17)19(25-20)12-11-15-7-3-2-4-8-15/h2-10,13-14,21,26,28H,11-12H2,1H3,(H,27,29)(H,30,31)