3-(dimethylamino)-3-methoxy-6-(phenylcarbonyl)cyclohexa-1,4-diene-1-carboxylic acid

Systemtic Name: 3-(dimethylamino)-3-methoxy-6-(phenylcarbonyl)cyclohexa-1,4-diene-1-carboxylic acid Openeye Name: 6-benzoyl-3-(dimethylamino)-3-methoxy-cyclohexa-1,4-diene-1-carboxylic acid CAS Name: 6-benzoyl-3-(dimethylamino)-3-methoxy-1-cyclohexa-1,4-dienecarboxylic acid IUPAC Name: 6-benzoyl-3-(dimethylamino)-3-methoxycyclohexa-1,4-diene-1-carboxylic acid Traditional Name: 6-benzoyl-3-(dimethylamino)-3-methoxy-cyclohexa-1,4-diene-1-carboxylic acid Formula: C17H19NO4 MolecularWeight: 301.33706

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1(C=CC(C(=C1)C(=O)O)C(=O)C2=CC=CC=C2)OC

Isomeric SMILES

CN(C)C1(C=CC(C(=C1)C(=O)O)C(=O)C2=CC=CC=C2)OC

InChI

InChI=1S/C17H19NO4/c1-18(2)17(22-3)10-9-13(14(11-17)16(20)21)15(19)12-7-5-4-6-8-12/h4-11,13H,1-3H3,(H,20,21)