methyl (E)-4-[2-(4-methylcyclohex-3-en-1-yl)propan-2-yl-(phenylmethyl)amino]but-2-enoate

Systemtic Name: methyl (E)-4-[2-(4-methylcyclohex-3-en-1-yl)propan-2-yl-(phenylmethyl)amino]but-2-enoate Openeye Name: methyl (E)-4-[benzyl-[1-methyl-1-(4-methylcyclohex-3-en-1-yl)ethyl]amino]but-2-enoate CAS Name: (E)-4-[2-(4-methyl-1-cyclohex-3-enyl)propan-2-yl-(phenylmethyl)amino]-2-butenoic acid methyl ester IUPAC Name: methyl (E)-4-[benzyl-[2-(4-methylcyclohex-3-en-1-yl)propan-2-yl]amino]but-2-enoate Traditional Name: (E)-4-[benzyl-[1-methyl-1-(4-methylcyclohex-3-en-1-yl)ethyl]amino]but-2-enoic acid methyl ester Formula: C22H31NO2 MolecularWeight: 341.48704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC(CC1)C(C)(C)N(CC=CC(=O)OC)CC2=CC=CC=C2

Isomeric SMILES

CC1=CCC(CC1)C(C)(C)N(C/C=C/C(=O)OC)CC2=CC=CC=C2

InChI

InChI=1S/C22H31NO2/c1-18-12-14-20(15-13-18)22(2,3)23(16-8-11-21(24)25-4)17-19-9-6-5-7-10-19/h5-12,20H,13-17H2,1-4H3/b11-8+