ethyl (E)-3-[5-methyl-2-[[6-oxidanylidene-1-(phenylmethyl)piperidin-3-yl]methyl]phenyl]prop-2-enoate

Systemtic Name: ethyl (E)-3-[5-methyl-2-[[6-oxidanylidene-1-(phenylmethyl)piperidin-3-yl]methyl]phenyl]prop-2-enoate Openeye Name: ethyl (E)-3-[2-[(1-benzyl-6-oxo-3-piperidyl)methyl]-5-methyl-phenyl]prop-2-enoate CAS Name: (E)-3-[5-methyl-2-[[6-oxo-1-(phenylmethyl)-3-piperidinyl]methyl]phenyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[2-[(1-benzyl-6-oxopiperidin-3-yl)methyl]-5-methylphenyl]prop-2-enoate Traditional Name: (E)-3-[2-[(1-benzyl-6-keto-3-piperidyl)methyl]-5-methyl-phenyl]acrylic acid ethyl ester Formula: C25H29NO3 MolecularWeight: 391.50266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC1=C(C=CC(=C1)C)CC2CCC(=O)N(C2)CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)/C=C/C1=C(C=CC(=C1)C)CC2CCC(=O)N(C2)CC3=CC=CC=C3

InChI

InChI=1S/C25H29NO3/c1-3-29-25(28)14-12-22-15-19(2)9-11-23(22)16-21-10-13-24(27)26(18-21)17-20-7-5-4-6-8-20/h4-9,11-12,14-15,21H,3,10,13,16-18H2,1-2H3/b14-12+