4-[(10,10-dimethyl-9-phenyl-8,10a-dihydro-5H-anthracen-2-yl)carbonylamino]benzoic acid

Systemtic Name: 4-[(10,10-dimethyl-9-phenyl-8,10a-dihydro-5H-anthracen-2-yl)carbonylamino]benzoic acid Openeye Name: 4-[(10,10-dimethyl-9-phenyl-8,10a-dihydro-5H-anthracene-2-carbonyl)amino]benzoic acid CAS Name: 4-[[(10,10-dimethyl-9-phenyl-8,10a-dihydro-5H-anthracen-2-yl)-oxomethyl]amino]benzoic acid IUPAC Name: 4-[(10,10-dimethyl-9-phenyl-8,10a-dihydro-5H-anthracene-2-carbonyl)amino]benzoic acid Traditional Name: 4-[(10,10-dimethyl-9-phenyl-8,10a-dihydro-5H-anthracene-2-carbonyl)amino]benzoic acid Formula: C30H27NO3 MolecularWeight: 449.54028

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2CC=CCC2=C(C3=C1C=CC(=C3)C(=O)NC4=CC=C(C=C4)C(=O)O)C5=CC=CC=C5)C

Isomeric SMILES

CC1(C2CC=CCC2=C(C3=C1C=CC(=C3)C(=O)NC4=CC=C(C=C4)C(=O)O)C5=CC=CC=C5)C

InChI

InChI=1S/C30H27NO3/c1-30(2)25-11-7-6-10-23(25)27(19-8-4-3-5-9-19)24-18-21(14-17-26(24)30)28(32)31-22-15-12-20(13-16-22)29(33)34/h3-9,12-18,25H,10-11H2,1-2H3,(H,31,32)(H,33,34)