1-[2-[(5-chloranyl-2-methoxycarbonyl-phenyl)amino]-2-oxidanylidene-ethyl]cycloheptane-1-carboxylic acid

Systemtic Name: 1-[2-[(5-chloranyl-2-methoxycarbonyl-phenyl)amino]-2-oxidanylidene-ethyl]cycloheptane-1-carboxylic acid Openeye Name: 1-[2-(5-chloro-2-methoxycarbonyl-anilino)-2-oxo-ethyl]cycloheptanecarboxylic acid CAS Name: 1-[2-(5-chloro-2-methoxycarbonylanilino)-2-oxoethyl]-1-cycloheptanecarboxylic acid IUPAC Name: 1-[2-(5-chloro-2-methoxycarbonylanilino)-2-oxoethyl]cycloheptane-1-carboxylic acid Traditional Name: 1-[2-(2-carbomethoxy-5-chloro-anilino)-2-keto-ethyl]cycloheptanecarboxylic acid Formula: C18H22ClNO5 MolecularWeight: 367.82398

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22ClNO5/c1-25-16(22)13-7-6-12(19)10-14(13)20-15(21)11-18(17(23)24)8-4-2-3-5-9-18/h6-7,10H,2-5,8-9,11H2,1H3,(H,20,21)(H,23,24)