methyl (2Z)-2-[1-[(1S)-1-phenylethyl]piperidin-2-ylidene]butanoate

Systemtic Name: methyl (2Z)-2-[1-[(1S)-1-phenylethyl]piperidin-2-ylidene]butanoate Openeye Name: methyl (2Z)-2-[1-[(1S)-1-phenylethyl]-2-piperidylidene]butanoate CAS Name: (2Z)-2-[1-[(1S)-1-phenylethyl]-2-piperidinylidene]butanoic acid methyl ester IUPAC Name: methyl (2Z)-2-[1-[(1S)-1-phenylethyl]piperidin-2-ylidene]butanoate Traditional Name: (2Z)-2-[1-[(1S)-1-phenylethyl]-2-piperidylidene]butyric acid methyl ester Formula: C18H25NO2 MolecularWeight: 287.3966

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C1CCCCN1C(C)C2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC/C(=C/1\CCCCN1[C@@H](C)C2=CC=CC=C2)/C(=O)OC

InChI

InChI=1S/C18H25NO2/c1-4-16(18(20)21-3)17-12-8-9-13-19(17)14(2)15-10-6-5-7-11-15/h5-7,10-11,14H,4,8-9,12-13H2,1-3H3/b17-16-/t14-/m0/s1