1-(4-methoxy-2,5-dimethyl-phenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid

Systemtic Name: 1-(4-methoxy-2,5-dimethyl-phenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid Openeye Name: 1-(4-methoxy-2,5-dimethyl-phenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid CAS Name: 1-(4-methoxy-2,5-dimethylphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid IUPAC Name: 1-(4-methoxy-2,5-dimethylphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid Traditional Name: 1-(4-methoxy-2,5-dimethyl-phenyl)-2,3,4,9-tetrahydro-1H-$b-carboline-3-carboxylic acid Formula: C21H22N2O3 MolecularWeight: 350.41098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C2C3=C(CC(N2)C(=O)O)C4=CC=CC=C4N3)C)OC

Isomeric SMILES

CC1=CC(=C(C=C1C2C3=C(CC(N2)C(=O)O)C4=CC=CC=C4N3)C)OC

InChI

InChI=1S/C21H22N2O3/c1-11-9-18(26-3)12(2)8-14(11)19-20-15(10-17(23-19)21(24)25)13-6-4-5-7-16(13)22-20/h4-9,17,19,22-23H,10H2,1-3H3,(H,24,25)