5-methoxy-3-(1-methoxyethylidene)-4-(pyridin-4-ylamino)-1,2-dihydro-1-benzazepine-2-carboxylic acid

Systemtic Name: 5-methoxy-3-(1-methoxyethylidene)-4-(pyridin-4-ylamino)-1,2-dihydro-1-benzazepine-2-carboxylic acid Openeye Name: 5-methoxy-3-(1-methoxyethylidene)-4-(4-pyridylamino)-1,2-dihydro-1-benzazepine-2-carboxylic acid CAS Name: 5-methoxy-3-(1-methoxyethylidene)-4-(pyridin-4-ylamino)-1,2-dihydro-1-benzazepine-2-carboxylic acid IUPAC Name: 5-methoxy-3-(1-methoxyethylidene)-4-(pyridin-4-ylamino)-1,2-dihydro-1-benzazepine-2-carboxylic acid Traditional Name: 5-methoxy-3-(1-methoxyethylidene)-4-(4-pyridylamino)-1,2-dihydro-1-benzazepine-2-carboxylic acid Formula: C20H21N3O4 MolecularWeight: 367.39844

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C(NC2=CC=CC=C2C(=C1NC3=CC=NC=C3)OC)C(=O)O)OC

Isomeric SMILES

CC(=C1C(NC2=CC=CC=C2C(=C1NC3=CC=NC=C3)OC)C(=O)O)OC

InChI

InChI=1S/C20H21N3O4/c1-12(26-2)16-17(22-13-8-10-21-11-9-13)19(27-3)14-6-4-5-7-15(14)23-18(16)20(24)25/h4-11,18,23H,1-3H3,(H,21,22)(H,24,25)