2-[8-methyl-2-(phenylcarbonyl)-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl]ethanoic acid

Systemtic Name: 2-[8-methyl-2-(phenylcarbonyl)-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl]ethanoic acid Openeye Name: 2-(2-benzoyl-8-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)acetic acid CAS Name: 2-(2-benzoyl-8-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)acetic acid IUPAC Name: 2-(2-benzoyl-8-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)acetic acid Traditional Name: 2-(2-benzoyl-8-methyl-3,4-dihydro-1H-pyrid[4,3-b]indol-5-yl)acetic acid Formula: C21H20N2O3 MolecularWeight: 348.3951

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C3=C2CN(CC3)C(=O)C4=CC=CC=C4)CC(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1)N(C3=C2CN(CC3)C(=O)C4=CC=CC=C4)CC(=O)O

InChI

InChI=1S/C21H20N2O3/c1-14-7-8-18-16(11-14)17-12-22(21(26)15-5-3-2-4-6-15)10-9-19(17)23(18)13-20(24)25/h2-8,11H,9-10,12-13H2,1H3,(H,24,25)