tert-butyl 2-[4-methyl-4-[[(2-methylphenyl)carbonylamino]methyl]cyclohexylidene]ethanoate

Systemtic Name: tert-butyl 2-[4-methyl-4-[[(2-methylphenyl)carbonylamino]methyl]cyclohexylidene]ethanoate Openeye Name: tert-butyl 2-[4-methyl-4-[[(2-methylbenzoyl)amino]methyl]cyclohexylidene]acetate CAS Name: 2-[4-methyl-4-[[[(2-methylphenyl)-oxomethyl]amino]methyl]cyclohexylidene]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[4-methyl-4-[[(2-methylbenzoyl)amino]methyl]cyclohexylidene]acetate Traditional Name: 2-[4-methyl-4-[(o-toluoylamino)methyl]cyclohexylidene]acetic acid tert-butyl ester Formula: C22H31NO3 MolecularWeight: 357.48644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NCC2(CCC(=CC(=O)OC(C)(C)C)CC2)C

Isomeric SMILES

CC1=CC=CC=C1C(=O)NCC2(CCC(=CC(=O)OC(C)(C)C)CC2)C

InChI

InChI=1S/C22H31NO3/c1-16-8-6-7-9-18(16)20(25)23-15-22(5)12-10-17(11-13-22)14-19(24)26-21(2,3)4/h6-9,14H,10-13,15H2,1-5H3,(H,23,25)