3-methyl-4-[(6-methyl-6,7,8,9-tetrahydro-5H-carbazol-3-yl)carbonylamino]benzoic acid

Systemtic Name: 3-methyl-4-[(6-methyl-6,7,8,9-tetrahydro-5H-carbazol-3-yl)carbonylamino]benzoic acid Openeye Name: 3-methyl-4-[(6-methyl-6,7,8,9-tetrahydro-5H-carbazole-3-carbonyl)amino]benzoic acid CAS Name: 3-methyl-4-[[(6-methyl-6,7,8,9-tetrahydro-5H-carbazol-3-yl)-oxomethyl]amino]benzoic acid IUPAC Name: 3-methyl-4-[(6-methyl-6,7,8,9-tetrahydro-5H-carbazole-3-carbonyl)amino]benzoic acid Traditional Name: 3-methyl-4-[(6-methyl-6,7,8,9-tetrahydro-5H-carbazole-3-carbonyl)amino]benzoic acid Formula: C22H22N2O3 MolecularWeight: 362.42168

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C3=C(N2)C=CC(=C3)C(=O)NC4=C(C=C(C=C4)C(=O)O)C

Isomeric SMILES

CC1CCC2=C(C1)C3=C(N2)C=CC(=C3)C(=O)NC4=C(C=C(C=C4)C(=O)O)C

InChI

InChI=1S/C22H22N2O3/c1-12-3-6-19-16(9-12)17-11-14(4-8-20(17)23-19)21(25)24-18-7-5-15(22(26)27)10-13(18)2/h4-5,7-8,10-12,23H,3,6,9H2,1-2H3,(H,24,25)(H,26,27)