4-[(2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-1-yl)methyl]-1,3-thiazole-2-carboxylic acid

Systemtic Name: 4-[(2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-1-yl)methyl]-1,3-thiazole-2-carboxylic acid Openeye Name: 4-[(2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl)methyl]thiazole-2-carboxylic acid CAS Name: 4-[(2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl)methyl]-2-thiazolecarboxylic acid IUPAC Name: 4-[(2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl)methyl]-1,3-thiazole-2-carboxylic acid Traditional Name: 4-[(2-keto-4,5-dihydro-3H-1-benzazepin-1-yl)methyl]thiazole-2-carboxylic acid Formula: C15H14N2O3S MolecularWeight: 302.34826

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2N(C(=O)C1)CC3=CSC(=N3)C(=O)O

Isomeric SMILES

C1CC2=CC=CC=C2N(C(=O)C1)CC3=CSC(=N3)C(=O)O

InChI

InChI=1S/C15H14N2O3S/c18-13-7-3-5-10-4-1-2-6-12(10)17(13)8-11-9-21-14(16-11)15(19)20/h1-2,4,6,9H,3,5,7-8H2,(H,19,20)