3-[(3-ethoxycarbonyl-5,9-dimethyl-benzo[h][1,6]naphthyridin-4-yl)amino]benzoic acid

Systemtic Name: 3-[(3-ethoxycarbonyl-5,9-dimethyl-benzo[h][1,6]naphthyridin-4-yl)amino]benzoic acid Openeye Name: 3-[(3-ethoxycarbonyl-5,9-dimethyl-benzo[h][1,6]naphthyridin-4-yl)amino]benzoic acid CAS Name: 3-[(3-ethoxycarbonyl-5,9-dimethyl-4-benzo[h][1,6]naphthyridinyl)amino]benzoic acid IUPAC Name: 3-[(3-ethoxycarbonyl-5,9-dimethylbenzo[h][1,6]naphthyridin-4-yl)amino]benzoic acid Traditional Name: 3-[(3-carbethoxy-5,9-dimethyl-benzo[h][1,6]naphthyridin-4-yl)amino]benzoic acid Formula: C24H21N3O4 MolecularWeight: 415.44124

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C3=C(C=CC(=C3)C)N=C(C2=C1NC4=CC=CC(=C4)C(=O)O)C

Isomeric SMILES

CCOC(=O)C1=CN=C2C3=C(C=CC(=C3)C)N=C(C2=C1NC4=CC=CC(=C4)C(=O)O)C

InChI

InChI=1S/C24H21N3O4/c1-4-31-24(30)18-12-25-21-17-10-13(2)8-9-19(17)26-14(3)20(21)22(18)27-16-7-5-6-15(11-16)23(28)29/h5-12H,4H2,1-3H3,(H,25,27)(H,28,29)