[(E)-[(2S,5S)-2-methyl-5-prop-1-en-2-yl-cyclohexylidene]amino] 4-methylbenzoate

Systemtic Name: [(E)-[(2S,5S)-2-methyl-5-prop-1-en-2-yl-cyclohexylidene]amino] 4-methylbenzoate Openeye Name: [(E)-[(2S,5S)-5-isopropenyl-2-methyl-cyclohexylidene]amino] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [(E)-[(2S,5S)-2-methyl-5-(1-methylethenyl)cyclohexylidene]amino] ester IUPAC Name: [(E)-[(2S,5S)-2-methyl-5-prop-1-en-2-ylcyclohexylidene]amino] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [(E)-[(2S,5S)-5-isopropenyl-2-methyl-cyclohexylidene]amino] ester Formula: C18H23NO2 MolecularWeight: 285.38072

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1=NOC(=O)C2=CC=C(C=C2)C)C(=C)C

Isomeric SMILES

C[C@H]\1CC[C@@H](C/C1=N\OC(=O)C2=CC=C(C=C2)C)C(=C)C

InChI

InChI=1S/C18H23NO2/c1-12(2)16-10-7-14(4)17(11-16)19-21-18(20)15-8-5-13(3)6-9-15/h5-6,8-9,14,16H,1,7,10-11H2,2-4H3/b19-17+/t14-,16-/m0/s1