(3Z)-4-bromanyl-5-methoxy-3-[1-(pyridin-3-ylamino)ethylidene]-1,2-dihydro-2-benzazepine-1-carboxylic acid

Systemtic Name: (3Z)-4-bromanyl-5-methoxy-3-[1-(pyridin-3-ylamino)ethylidene]-1,2-dihydro-2-benzazepine-1-carboxylic acid Openeye Name: (3Z)-4-bromo-5-methoxy-3-[1-(3-pyridylamino)ethylidene]-1,2-dihydro-2-benzazepine-1-carboxylic acid CAS Name: (3Z)-4-bromo-5-methoxy-3-[1-(3-pyridinylamino)ethylidene]-1,2-dihydro-2-benzazepine-1-carboxylic acid IUPAC Name: (3Z)-4-bromo-5-methoxy-3-[1-(pyridin-3-ylamino)ethylidene]-1,2-dihydro-2-benzazepine-1-carboxylic acid Traditional Name: (3Z)-4-bromo-5-methoxy-3-[1-(3-pyridylamino)ethylidene]-1,2-dihydro-2-benzazepine-1-carboxylic acid Formula: C19H18BrN3O3 MolecularWeight: 416.26852

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C(=C(C2=CC=CC=C2C(N1)C(=O)O)OC)Br)NC3=CN=CC=C3

Isomeric SMILES

C/C(=C/1\C(=C(C2=CC=CC=C2C(N1)C(=O)O)OC)Br)/NC3=CN=CC=C3

InChI

InChI=1S/C19H18BrN3O3/c1-11(22-12-6-5-9-21-10-12)16-15(20)18(26-2)14-8-4-3-7-13(14)17(23-16)19(24)25/h3-10,17,22-23H,1-2H3,(H,24,25)/b16-11-