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2-[(2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepin-3-yl)sulfanyl]benzoic acid

2-[(2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepin-3-yl)sulfanyl]benzoic acid

Systemtic Name:2-[(2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepin-3-yl)sulfanyl]benzoic acid
Openeye Name:2-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-3-yl)sulfanyl]benzoic acid
CAS Name:2-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-3-yl)thio]benzoic acid
IUPAC Name:2-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-3-yl)sulfanyl]benzoic acid
Traditional Name:2-[(2-keto-1,3,4,5-tetrahydro-1-benzazepin-3-yl)thio]benzoic acid
Formula: C17H15NO3S
MolecularWeight: 313.3709
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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2NC(=O)C1SC3=CC=CC=C3C(=O)O


Isomeric SMILES

C1CC2=CC=CC=C2NC(=O)C1SC3=CC=CC=C3C(=O)O


InChI

InChI=1S/C17H15NO3S/c19-16-15(10-9-11-5-1-3-7-13(11)18-16)22-14-8-4-2-6-12(14)17(20)21/h1-8,15H,9-10H2,(H,18,19)(H,20,21)


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