1-[2-[(2-tert-butylphenyl)amino]-2-oxidanylidene-ethyl]cycloheptane-1-carboxylic acid

Systemtic Name: 1-[2-[(2-tert-butylphenyl)amino]-2-oxidanylidene-ethyl]cycloheptane-1-carboxylic acid Openeye Name: 1-[2-(2-tert-butylanilino)-2-oxo-ethyl]cycloheptanecarboxylic acid CAS Name: 1-[2-(2-tert-butylanilino)-2-oxoethyl]-1-cycloheptanecarboxylic acid IUPAC Name: 1-[2-(2-tert-butylanilino)-2-oxoethyl]cycloheptane-1-carboxylic acid Traditional Name: 1-[2-(2-tert-butylanilino)-2-keto-ethyl]cycloheptanecarboxylic acid Formula: C20H29NO3 MolecularWeight: 331.44916

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC=C1NC(=O)CC2(CCCCCC2)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=CC=C1NC(=O)CC2(CCCCCC2)C(=O)O

InChI

InChI=1S/C20H29NO3/c1-19(2,3)15-10-6-7-11-16(15)21-17(22)14-20(18(23)24)12-8-4-5-9-13-20/h6-7,10-11H,4-5,8-9,12-14H2,1-3H3,(H,21,22)(H,23,24)