N-[(2S)-1-[(3-methoxyphenyl)amino]-1-oxidanylidene-propan-2-yl]-9H-pyrido[3,4-b]indole-3-carboxamide

Systemtic Name: N-[(2S)-1-[(3-methoxyphenyl)amino]-1-oxidanylidene-propan-2-yl]-9H-pyrido[3,4-b]indole-3-carboxamide Openeye Name: N-[(1S)-2-(3-methoxyanilino)-1-methyl-2-oxo-ethyl]-9H-pyrido[3,4-b]indole-3-carboxamide CAS Name: N-[(2S)-1-(3-methoxyanilino)-1-oxopropan-2-yl]-9H-pyrido[3,4-b]indole-3-carboxamide IUPAC Name: N-[(2S)-1-(3-methoxyanilino)-1-oxopropan-2-yl]-9H-pyrido[3,4-b]indole-3-carboxamide Traditional Name: N-[(1S)-2-keto-2-(m-anisidino)-1-methyl-ethyl]-9H-$b-carboline-3-carboxamide Formula: C22H20N4O3 MolecularWeight: 388.4192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC=C1)OC)NC(=O)C2=NC=C3C(=C2)C4=CC=CC=C4N3

Isomeric SMILES

C[C@@H](C(=O)NC1=CC(=CC=C1)OC)NC(=O)C2=NC=C3C(=C2)C4=CC=CC=C4N3

InChI

InChI=1S/C22H20N4O3/c1-13(21(27)25-14-6-5-7-15(10-14)29-2)24-22(28)19-11-17-16-8-3-4-9-18(16)26-20(17)12-23-19/h3-13,26H,1-2H3,(H,24,28)(H,25,27)/t13-/m0/s1