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

Systemtic Name: 1-[2-[(3-ethylphenyl)amino]-2-oxidanylidene-ethyl]cycloheptane-1-carboxylic acid Openeye Name: 1-[2-(3-ethylanilino)-2-oxo-ethyl]cycloheptanecarboxylic acid CAS Name: 1-[2-(3-ethylanilino)-2-oxoethyl]-1-cycloheptanecarboxylic acid IUPAC Name: 1-[2-(3-ethylanilino)-2-oxoethyl]cycloheptane-1-carboxylic acid Traditional Name: 1-[2-(3-ethylanilino)-2-keto-ethyl]cycloheptanecarboxylic acid Formula: C18H25NO3 MolecularWeight: 303.396

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=O)CC2(CCCCCC2)C(=O)O

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=O)CC2(CCCCCC2)C(=O)O

InChI

InChI=1S/C18H25NO3/c1-2-14-8-7-9-15(12-14)19-16(20)13-18(17(21)22)10-5-3-4-6-11-18/h7-9,12H,2-6,10-11,13H2,1H3,(H,19,20)(H,21,22)