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

Systemtic Name: 1-[2-[[3-(cyclopropylcarbamoyl)phenyl]amino]-2-oxidanylidene-ethyl]cycloheptane-1-carboxylic acid Openeye Name: 1-[2-[3-(cyclopropylcarbamoyl)anilino]-2-oxo-ethyl]cycloheptanecarboxylic acid CAS Name: 1-[2-[3-[(cyclopropylamino)-oxomethyl]anilino]-2-oxoethyl]-1-cycloheptanecarboxylic acid IUPAC Name: 1-[2-[3-(cyclopropylcarbamoyl)anilino]-2-oxoethyl]cycloheptane-1-carboxylic acid Traditional Name: 1-[2-[3-(cyclopropylcarbamoyl)anilino]-2-keto-ethyl]cycloheptanecarboxylic acid Formula: C20H26N2O4 MolecularWeight: 358.43144

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)(CC(=O)NC2=CC=CC(=C2)C(=O)NC3CC3)C(=O)O

Isomeric SMILES

C1CCCC(CC1)(CC(=O)NC2=CC=CC(=C2)C(=O)NC3CC3)C(=O)O

InChI

InChI=1S/C20H26N2O4/c23-17(13-20(19(25)26)10-3-1-2-4-11-20)21-16-7-5-6-14(12-16)18(24)22-15-8-9-15/h5-7,12,15H,1-4,8-11,13H2,(H,21,23)(H,22,24)(H,25,26)