6-(phenylmethyl)-4,5,7,8-tetrahydrothieno[2,3-d]azepine-2-carboxylic acid

Systemtic Name: 6-(phenylmethyl)-4,5,7,8-tetrahydrothieno[2,3-d]azepine-2-carboxylic acid Openeye Name: 6-benzyl-4,5,7,8-tetrahydrothieno[2,3-d]azepine-2-carboxylic acid CAS Name: 6-(phenylmethyl)-4,5,7,8-tetrahydrothieno[2,3-d]azepine-2-carboxylic acid IUPAC Name: 6-benzyl-4,5,7,8-tetrahydrothieno[2,3-d]azepine-2-carboxylic acid Traditional Name: 6-benzyl-4,5,7,8-tetrahydrothien[2,3-d]azepine-2-carboxylic acid Formula: C16H17NO2S MolecularWeight: 287.37668

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC2=C1C=C(S2)C(=O)O)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCC2=C1C=C(S2)C(=O)O)CC3=CC=CC=C3

InChI

InChI=1S/C16H17NO2S/c18-16(19)15-10-13-6-8-17(9-7-14(13)20-15)11-12-4-2-1-3-5-12/h1-5,10H,6-9,11H2,(H,18,19)