[(Z)-[(2S,5S)-2,5-dimethyl-1-prop-2-enyl-piperidin-4-ylidene]amino] benzoate

Systemtic Name: [(Z)-[(2S,5S)-2,5-dimethyl-1-prop-2-enyl-piperidin-4-ylidene]amino] benzoate Openeye Name: [(Z)-[(2S,5S)-1-allyl-2,5-dimethyl-4-piperidylidene]amino] benzoate CAS Name: benzoic acid [(Z)-[(2S,5S)-2,5-dimethyl-1-prop-2-enyl-4-piperidinylidene]amino] ester IUPAC Name: [(Z)-[(2S,5S)-2,5-dimethyl-1-prop-2-enylpiperidin-4-ylidene]amino] benzoate Traditional Name: benzoic acid [(Z)-[(2S,5S)-1-allyl-2,5-dimethyl-4-piperidylidene]amino] ester Formula: C17H22N2O2 MolecularWeight: 286.36878

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=NOC(=O)C2=CC=CC=C2)C(CN1CC=C)C

Isomeric SMILES

C[C@H]1C/C(=N/OC(=O)C2=CC=CC=C2)/[C@H](CN1CC=C)C

InChI

InChI=1S/C17H22N2O2/c1-4-10-19-12-13(2)16(11-14(19)3)18-21-17(20)15-8-6-5-7-9-15/h4-9,13-14H,1,10-12H2,2-3H3/b18-16-/t13-,14-/m0/s1