9-(4-phenylmethoxyphenyl)carbonyl-1,2,3,4-tetrahydrocarbazole-4-carboxylic acid

Systemtic Name: 9-(4-phenylmethoxyphenyl)carbonyl-1,2,3,4-tetrahydrocarbazole-4-carboxylic acid Openeye Name: 9-(4-benzyloxybenzoyl)-1,2,3,4-tetrahydrocarbazole-4-carboxylic acid CAS Name: 9-[oxo-(4-phenylmethoxyphenyl)methyl]-1,2,3,4-tetrahydrocarbazole-4-carboxylic acid IUPAC Name: 9-(4-phenylmethoxybenzoyl)-1,2,3,4-tetrahydrocarbazole-4-carboxylic acid Traditional Name: 9-(4-benzoxybenzoyl)-1,2,3,4-tetrahydrocarbazole-4-carboxylic acid Formula: C27H23NO4 MolecularWeight: 425.47582

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=C(C1)N(C3=CC=CC=C32)C(=O)C4=CC=C(C=C4)OCC5=CC=CC=C5)C(=O)O

Isomeric SMILES

C1CC(C2=C(C1)N(C3=CC=CC=C32)C(=O)C4=CC=C(C=C4)OCC5=CC=CC=C5)C(=O)O

InChI

InChI=1S/C27H23NO4/c29-26(19-13-15-20(16-14-19)32-17-18-7-2-1-3-8-18)28-23-11-5-4-9-21(23)25-22(27(30)31)10-6-12-24(25)28/h1-5,7-9,11,13-16,22H,6,10,12,17H2,(H,30,31)