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

Systemtic Name: 4-azanyl-2-[[1-(2-ethoxyphenyl)-9H-pyrido[3,4-b]indol-3-yl]carbonylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-amino-2-[[1-(2-ethoxyphenyl)-9H-pyrido[3,4-b]indole-3-carbonyl]amino]-4-oxo-butanoic acid CAS Name: 4-amino-2-[[[1-(2-ethoxyphenyl)-9H-pyrido[3,4-b]indol-3-yl]-oxomethyl]amino]-4-oxobutanoic acid IUPAC Name: 4-amino-2-[[1-(2-ethoxyphenyl)-9H-pyrido[3,4-b]indole-3-carbonyl]amino]-4-oxobutanoic acid Traditional Name: 4-amino-4-keto-2-[(1-o-phenetyl-9H-$b-carboline-3-carbonyl)amino]butyric acid Formula: C24H22N4O5 MolecularWeight: 446.45528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C2=C3C(=CC(=N2)C(=O)NC(CC(=O)N)C(=O)O)C4=CC=CC=C4N3

Isomeric SMILES

CCOC1=CC=CC=C1C2=C3C(=CC(=N2)C(=O)NC(CC(=O)N)C(=O)O)C4=CC=CC=C4N3

InChI

InChI=1S/C24H22N4O5/c1-2-33-19-10-6-4-8-14(19)21-22-15(13-7-3-5-9-16(13)26-22)11-17(27-21)23(30)28-18(24(31)32)12-20(25)29/h3-11,18,26H,2,12H2,1H3,(H2,25,29)(H,28,30)(H,31,32)