2-[(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)carbamoyl]benzoic acid

Systemtic Name: 2-[(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)carbamoyl]benzoic acid Openeye Name: 2-[(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)carbamoyl]benzoic acid CAS Name: 2-[[(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)amino]-oxomethyl]benzoic acid IUPAC Name: 2-[(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)carbamoyl]benzoic acid Traditional Name: 2-[(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)carbamoyl]benzoic acid Formula: C20H17N3O3 MolecularWeight: 347.36728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC3=C(CCN3NC(=O)C4=CC=CC=C4C(=O)O)C=C2C=C1

Isomeric SMILES

CC1=CC2=NC3=C(CCN3NC(=O)C4=CC=CC=C4C(=O)O)C=C2C=C1

InChI

InChI=1S/C20H17N3O3/c1-12-6-7-13-11-14-8-9-23(18(14)21-17(13)10-12)22-19(24)15-4-2-3-5-16(15)20(25)26/h2-7,10-11H,8-9H2,1H3,(H,22,24)(H,25,26)