6-methoxy-9-(phenylcarbonyl)-1,2,3,4-tetrahydrocarbazole-4-carboxylic acid

Systemtic Name: 6-methoxy-9-(phenylcarbonyl)-1,2,3,4-tetrahydrocarbazole-4-carboxylic acid Openeye Name: 9-benzoyl-6-methoxy-1,2,3,4-tetrahydrocarbazole-4-carboxylic acid CAS Name: 9-benzoyl-6-methoxy-1,2,3,4-tetrahydrocarbazole-4-carboxylic acid IUPAC Name: 9-benzoyl-6-methoxy-1,2,3,4-tetrahydrocarbazole-4-carboxylic acid Traditional Name: 9-benzoyl-6-methoxy-1,2,3,4-tetrahydrocarbazole-4-carboxylic acid Formula: C21H19NO4 MolecularWeight: 349.37986

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N(C3=C2C(CCC3)C(=O)O)C(=O)C4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)N(C3=C2C(CCC3)C(=O)O)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H19NO4/c1-26-14-10-11-17-16(12-14)19-15(21(24)25)8-5-9-18(19)22(17)20(23)13-6-3-2-4-7-13/h2-4,6-7,10-12,15H,5,8-9H2,1H3,(H,24,25)