4-[(E)-3-(3,5-dimethoxy-4-oxidanyl-phenyl)prop-2-enoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate

Systemtic Name: 4-[(E)-3-(3,5-dimethoxy-4-oxidanyl-phenyl)prop-2-enoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Openeye Name: 4-[(E)-3-(4-hydroxy-3,5-dimethoxy-phenyl)prop-2-enoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate CAS Name: 4-[(E)-3-(4-hydroxy-3,5-dimethoxyphenyl)-1-oxoprop-2-enyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate IUPAC Name: 4-[(E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Traditional Name: 4-[(E)-3-(4-hydroxy-3,5-dimethoxy-phenyl)acryloyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Formula: C18H18NO6- MolecularWeight: 344.33862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)C=CC2=CC(=C(C(=C2)OC)O)OC)C)C(=O)[O-]

Isomeric SMILES

CC1=C(NC(=C1C(=O)/C=C/C2=CC(=C(C(=C2)OC)O)OC)C)C(=O)[O-]

InChI

InChI=1S/C18H19NO6/c1-9-15(10(2)19-16(9)18(22)23)12(20)6-5-11-7-13(24-3)17(21)14(8-11)25-4/h5-8,19,21H,1-4H3,(H,22,23)/p-1/b6-5+