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

Systemtic Name: 9-(4-chlorophenyl)carbonyl-6-methoxy-1,2,3,4-tetrahydrocarbazole-2-carboxylic acid Openeye Name: 9-(4-chlorobenzoyl)-6-methoxy-1,2,3,4-tetrahydrocarbazole-2-carboxylic acid CAS Name: 9-[(4-chlorophenyl)-oxomethyl]-6-methoxy-1,2,3,4-tetrahydrocarbazole-2-carboxylic acid IUPAC Name: 9-(4-chlorobenzoyl)-6-methoxy-1,2,3,4-tetrahydrocarbazole-2-carboxylic acid Traditional Name: 9-(4-chlorobenzoyl)-6-methoxy-1,2,3,4-tetrahydrocarbazole-2-carboxylic acid Formula: C21H18ClNO4 MolecularWeight: 383.82492

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N(C3=C2CCC(C3)C(=O)O)C(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

COC1=CC2=C(C=C1)N(C3=C2CCC(C3)C(=O)O)C(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H18ClNO4/c1-27-15-7-9-18-17(11-15)16-8-4-13(21(25)26)10-19(16)23(18)20(24)12-2-5-14(22)6-3-12/h2-3,5-7,9,11,13H,4,8,10H2,1H3,(H,25,26)