4-[(5,5-dimethyl-8-thiophen-2-yl-6H-naphthalen-2-yl)carbonylamino]benzoic acid

Systemtic Name: 4-[(5,5-dimethyl-8-thiophen-2-yl-6H-naphthalen-2-yl)carbonylamino]benzoic acid Openeye Name: 4-[[5,5-dimethyl-8-(2-thienyl)-6H-naphthalene-2-carbonyl]amino]benzoic acid CAS Name: 4-[[(5,5-dimethyl-8-thiophen-2-yl-6H-naphthalen-2-yl)-oxomethyl]amino]benzoic acid IUPAC Name: 4-[(5,5-dimethyl-8-thiophen-2-yl-6H-naphthalene-2-carbonyl)amino]benzoic acid Traditional Name: 4-[[5,5-dimethyl-8-(2-thienyl)-6H-naphthalene-2-carbonyl]amino]benzoic acid Formula: C24H21NO3S MolecularWeight: 403.49344

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC=C(C2=C1C=CC(=C2)C(=O)NC3=CC=C(C=C3)C(=O)O)C4=CC=CS4)C

Isomeric SMILES

CC1(CC=C(C2=C1C=CC(=C2)C(=O)NC3=CC=C(C=C3)C(=O)O)C4=CC=CS4)C

InChI

InChI=1S/C24H21NO3S/c1-24(2)12-11-18(21-4-3-13-29-21)19-14-16(7-10-20(19)24)22(26)25-17-8-5-15(6-9-17)23(27)28/h3-11,13-14H,12H2,1-2H3,(H,25,26)(H,27,28)