1-[2-[(2-methoxycarbonylthiophen-3-yl)amino]-2-oxidanylidene-ethyl]cycloheptane-1-carboxylic acid

Systemtic Name: 1-[2-[(2-methoxycarbonylthiophen-3-yl)amino]-2-oxidanylidene-ethyl]cycloheptane-1-carboxylic acid Openeye Name: 1-[2-[(2-methoxycarbonyl-3-thienyl)amino]-2-oxo-ethyl]cycloheptanecarboxylic acid CAS Name: 1-[2-[(2-methoxycarbonyl-3-thiophenyl)amino]-2-oxoethyl]-1-cycloheptanecarboxylic acid IUPAC Name: 1-[2-[(2-methoxycarbonylthiophen-3-yl)amino]-2-oxoethyl]cycloheptane-1-carboxylic acid Traditional Name: 1-[2-[(2-carbomethoxy-3-thienyl)amino]-2-keto-ethyl]cycloheptanecarboxylic acid Formula: C16H21NO5S MolecularWeight: 339.40664

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)NC(=O)CC2(CCCCCC2)C(=O)O

Isomeric SMILES

COC(=O)C1=C(C=CS1)NC(=O)CC2(CCCCCC2)C(=O)O

InChI

InChI=1S/C16H21NO5S/c1-22-14(19)13-11(6-9-23-13)17-12(18)10-16(15(20)21)7-4-2-3-5-8-16/h6,9H,2-5,7-8,10H2,1H3,(H,17,18)(H,20,21)