5-(phenoxymethyl)-6,7,8,9-tetrahydro-5H-pyrido[3,4-b]indole-3-carboxylic acid

Systemtic Name: 5-(phenoxymethyl)-6,7,8,9-tetrahydro-5H-pyrido[3,4-b]indole-3-carboxylic acid Openeye Name: 5-(phenoxymethyl)-6,7,8,9-tetrahydro-5H-pyrido[3,4-b]indole-3-carboxylic acid CAS Name: 5-(phenoxymethyl)-6,7,8,9-tetrahydro-5H-pyrido[3,4-b]indole-3-carboxylic acid IUPAC Name: 5-(phenoxymethyl)-6,7,8,9-tetrahydro-5H-pyrido[3,4-b]indole-3-carboxylic acid Traditional Name: 5-(phenoxymethyl)-6,7,8,9-tetrahydro-5H-$b-carboline-3-carboxylic acid Formula: C19H18N2O3 MolecularWeight: 322.35782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=C(C1)NC3=CN=C(C=C32)C(=O)O)COC4=CC=CC=C4

Isomeric SMILES

C1CC(C2=C(C1)NC3=CN=C(C=C32)C(=O)O)COC4=CC=CC=C4

InChI

InChI=1S/C19H18N2O3/c22-19(23)16-9-14-17(10-20-16)21-15-8-4-5-12(18(14)15)11-24-13-6-2-1-3-7-13/h1-3,6-7,9-10,12,21H,4-5,8,11H2,(H,22,23)