9-(4-dimethylaminophenyl)carbonyl-6-(3-methylbutoxy)-1,2,3,4-tetrahydrocarbazole-3-carboxylic acid

Systemtic Name: 9-(4-dimethylaminophenyl)carbonyl-6-(3-methylbutoxy)-1,2,3,4-tetrahydrocarbazole-3-carboxylic acid Openeye Name: 9-[4-(dimethylamino)benzoyl]-6-isopentyloxy-1,2,3,4-tetrahydrocarbazole-3-carboxylic acid CAS Name: 9-[(4-dimethylaminophenyl)-oxomethyl]-6-(3-methylbutoxy)-1,2,3,4-tetrahydrocarbazole-3-carboxylic acid IUPAC Name: 9-[4-(dimethylamino)benzoyl]-6-(3-methylbutoxy)-1,2,3,4-tetrahydrocarbazole-3-carboxylic acid Traditional Name: 9-[4-(dimethylamino)benzoyl]-6-isoamoxy-1,2,3,4-tetrahydrocarbazole-3-carboxylic acid Formula: C27H32N2O4 MolecularWeight: 448.55398

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC2=C(C=C1)N(C3=C2CC(CC3)C(=O)O)C(=O)C4=CC=C(C=C4)N(C)C

Isomeric SMILES

CC(C)CCOC1=CC2=C(C=C1)N(C3=C2CC(CC3)C(=O)O)C(=O)C4=CC=C(C=C4)N(C)C

InChI

InChI=1S/C27H32N2O4/c1-17(2)13-14-33-21-10-12-25-23(16-21)22-15-19(27(31)32)7-11-24(22)29(25)26(30)18-5-8-20(9-6-18)28(3)4/h5-6,8-10,12,16-17,19H,7,11,13-15H2,1-4H3,(H,31,32)