4-[(5,5-dimethyl-8-oxidanylidene-6,7-dihydronaphthalen-2-yl)carbamoyl]benzoic acid

Systemtic Name: 4-[(5,5-dimethyl-8-oxidanylidene-6,7-dihydronaphthalen-2-yl)carbamoyl]benzoic acid Openeye Name: 4-[(1,1-dimethyl-4-oxo-tetralin-6-yl)carbamoyl]benzoic acid CAS Name: 4-[[(5,5-dimethyl-8-oxo-6,7-dihydronaphthalen-2-yl)amino]-oxomethyl]benzoic acid IUPAC Name: 4-[(5,5-dimethyl-8-oxo-6,7-dihydronaphthalen-2-yl)carbamoyl]benzoic acid Traditional Name: 4-[(4-keto-1,1-dimethyl-tetralin-6-yl)carbamoyl]benzoic acid Formula: C20H19NO4 MolecularWeight: 337.36916

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(=O)C2=C1C=CC(=C2)NC(=O)C3=CC=C(C=C3)C(=O)O)C

Isomeric SMILES

CC1(CCC(=O)C2=C1C=CC(=C2)NC(=O)C3=CC=C(C=C3)C(=O)O)C

InChI

InChI=1S/C20H19NO4/c1-20(2)10-9-17(22)15-11-14(7-8-16(15)20)21-18(23)12-3-5-13(6-4-12)19(24)25/h3-8,11H,9-10H2,1-2H3,(H,21,23)(H,24,25)