methyl (E)-3-[3-methoxy-4-oxidanyl-5-(pyrrolidin-1-ylmethyl)phenyl]prop-2-enoate

Systemtic Name: methyl (E)-3-[3-methoxy-4-oxidanyl-5-(pyrrolidin-1-ylmethyl)phenyl]prop-2-enoate Openeye Name: methyl (E)-3-[4-hydroxy-3-methoxy-5-(pyrrolidin-1-ylmethyl)phenyl]prop-2-enoate CAS Name: (E)-3-[4-hydroxy-3-methoxy-5-(1-pyrrolidinylmethyl)phenyl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-[4-hydroxy-3-methoxy-5-(pyrrolidin-1-ylmethyl)phenyl]prop-2-enoate Traditional Name: (E)-3-[4-hydroxy-3-methoxy-5-(pyrrolidinomethyl)phenyl]acrylic acid methyl ester Formula: C16H21NO4 MolecularWeight: 291.34224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)CN2CCCC2)C=CC(=O)OC

Isomeric SMILES

COC1=CC(=CC(=C1O)CN2CCCC2)/C=C/C(=O)OC

InChI

InChI=1S/C16H21NO4/c1-20-14-10-12(5-6-15(18)21-2)9-13(16(14)19)11-17-7-3-4-8-17/h5-6,9-10,19H,3-4,7-8,11H2,1-2H3/b6-5+