3-oxidanylidene-2-(2,3,4,5-tetrahydro-1H-1-benzazepin-2-yl)prop-2-enoic acid

Systemtic Name: 3-oxidanylidene-2-(2,3,4,5-tetrahydro-1H-1-benzazepin-2-yl)prop-2-enoic acid Openeye Name: 3-oxo-2-(2,3,4,5-tetrahydro-1H-1-benzazepin-2-yl)prop-2-enoic acid CAS Name: 3-oxo-2-(2,3,4,5-tetrahydro-1H-1-benzazepin-2-yl)-2-propenoic acid IUPAC Name: 3-oxo-2-(2,3,4,5-tetrahydro-1H-1-benzazepin-2-yl)prop-2-enoic acid Traditional Name: 3-keto-2-(2,3,4,5-tetrahydro-1H-1-benzazepin-2-yl)acrylic acid Formula: C13H13NO3 MolecularWeight: 231.24722

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC2=CC=CC=C2C1)C(=C=O)C(=O)O

Isomeric SMILES

C1CC(NC2=CC=CC=C2C1)C(=C=O)C(=O)O

InChI

InChI=1S/C13H13NO3/c15-8-10(13(16)17)12-7-3-5-9-4-1-2-6-11(9)14-12/h1-2,4,6,12,14H,3,5,7H2,(H,16,17)