[1-[(Z)-2-cyano-3-(4-methoxy-3-oxidanyl-phenyl)prop-2-enoyl]piperidin-4-yl]azanium

Systemtic Name: [1-[(Z)-2-cyano-3-(4-methoxy-3-oxidanyl-phenyl)prop-2-enoyl]piperidin-4-yl]azanium Openeye Name: [1-[(Z)-2-cyano-3-(3-hydroxy-4-methoxy-phenyl)prop-2-enoyl]-4-piperidyl]ammonium CAS Name: [1-[(Z)-2-cyano-3-(3-hydroxy-4-methoxyphenyl)-1-oxoprop-2-enyl]-4-piperidinyl]ammonium IUPAC Name: [1-[(Z)-2-cyano-3-(3-hydroxy-4-methoxyphenyl)prop-2-enoyl]piperidin-4-yl]azanium Traditional Name: [1-[(Z)-2-cyano-3-(3-hydroxy-4-methoxy-phenyl)acryloyl]-4-piperidyl]ammonium Formula: C16H20N3O3+ MolecularWeight: 302.3483

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=C(C#N)C(=O)N2CCC(CC2)[NH3+])O

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C(/C#N)\C(=O)N2CCC(CC2)[NH3+])O

InChI

InChI=1S/C16H19N3O3/c1-22-15-3-2-11(9-14(15)20)8-12(10-17)16(21)19-6-4-13(18)5-7-19/h2-3,8-9,13,20H,4-7,18H2,1H3/p+1/b12-8-