4-[(5,5,8,8-tetramethyl-6,7-dihydroquinoxalin-2-yl)carbamoyl]benzoic acid

Systemtic Name: 4-[(5,5,8,8-tetramethyl-6,7-dihydroquinoxalin-2-yl)carbamoyl]benzoic acid Openeye Name: 4-[(5,5,8,8-tetramethyl-6,7-dihydroquinoxalin-2-yl)carbamoyl]benzoic acid CAS Name: 4-[oxo-[(5,5,8,8-tetramethyl-6,7-dihydroquinoxalin-2-yl)amino]methyl]benzoic acid IUPAC Name: 4-[(5,5,8,8-tetramethyl-6,7-dihydroquinoxalin-2-yl)carbamoyl]benzoic acid Traditional Name: 4-[(5,5,8,8-tetramethyl-6,7-dihydroquinoxalin-2-yl)carbamoyl]benzoic acid Formula: C20H23N3O3 MolecularWeight: 353.41492

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(C2=NC(=CN=C21)NC(=O)C3=CC=C(C=C3)C(=O)O)(C)C)C

Isomeric SMILES

CC1(CCC(C2=NC(=CN=C21)NC(=O)C3=CC=C(C=C3)C(=O)O)(C)C)C

InChI

InChI=1S/C20H23N3O3/c1-19(2)9-10-20(3,4)16-15(19)21-11-14(22-16)23-17(24)12-5-7-13(8-6-12)18(25)26/h5-8,11H,9-10H2,1-4H3,(H,25,26)(H,22,23,24)