methyl 1-[2-(3,4-dichlorophenyl)ethanoylamino]cycloheptane-1-carboxylate

Systemtic Name: methyl 1-[2-(3,4-dichlorophenyl)ethanoylamino]cycloheptane-1-carboxylate Openeye Name: methyl 1-[[2-(3,4-dichlorophenyl)acetyl]amino]cycloheptanecarboxylate CAS Name: 1-[[2-(3,4-dichlorophenyl)-1-oxoethyl]amino]-1-cycloheptanecarboxylic acid methyl ester IUPAC Name: methyl 1-[[2-(3,4-dichlorophenyl)acetyl]amino]cycloheptane-1-carboxylate Traditional Name: 1-[[2-(3,4-dichlorophenyl)acetyl]amino]cycloheptanecarboxylic acid methyl ester Formula: C17H21Cl2NO3 MolecularWeight: 358.25954

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CCCCCC1)NC(=O)CC2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

COC(=O)C1(CCCCCC1)NC(=O)CC2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C17H21Cl2NO3/c1-23-16(22)17(8-4-2-3-5-9-17)20-15(21)11-12-6-7-13(18)14(19)10-12/h6-7,10H,2-5,8-9,11H2,1H3,(H,20,21)