3-[[(E)-(4-bromanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]amino]-1-phenyl-cyclopentane-1-carboxylic acid

Systemtic Name: 3-[[(E)-(4-bromanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]amino]-1-phenyl-cyclopentane-1-carboxylic acid Openeye Name: 3-[[(E)-(4-bromo-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]amino]-1-phenyl-cyclopentanecarboxylic acid CAS Name: 3-[[(E)-(4-bromo-6-oxo-1-cyclohexa-2,4-dienylidene)methyl]amino]-1-phenyl-1-cyclopentanecarboxylic acid IUPAC Name: 3-[[(E)-(4-bromo-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]-1-phenylcyclopentane-1-carboxylic acid Traditional Name: 3-[[(E)-(4-bromo-6-keto-cyclohexa-2,4-dien-1-ylidene)methyl]amino]-1-phenyl-cyclopentanecarboxylic acid Formula: C19H18BrNO3 MolecularWeight: 388.25512

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC1NC=C2C=CC(=CC2=O)Br)(C3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1CC(CC1N/C=C/2\C=CC(=CC2=O)Br)(C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C19H18BrNO3/c20-15-7-6-13(17(22)10-15)12-21-16-8-9-19(11-16,18(23)24)14-4-2-1-3-5-14/h1-7,10,12,16,21H,8-9,11H2,(H,23,24)/b13-12+