methyl 4-[(E)-3-[1,3-benzodioxol-5-ylmethyl(ethyl)amino]-3-oxidanylidene-prop-1-enyl]benzoate

Systemtic Name: methyl 4-[(E)-3-[1,3-benzodioxol-5-ylmethyl(ethyl)amino]-3-oxidanylidene-prop-1-enyl]benzoate Openeye Name: methyl 4-[(E)-3-[1,3-benzodioxol-5-ylmethyl(ethyl)amino]-3-oxo-prop-1-enyl]benzoate CAS Name: 4-[(E)-3-[1,3-benzodioxol-5-ylmethyl(ethyl)amino]-3-oxoprop-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-3-[1,3-benzodioxol-5-ylmethyl(ethyl)amino]-3-oxoprop-1-enyl]benzoate Traditional Name: 4-[(E)-3-[ethyl(piperonyl)amino]-3-keto-prop-1-enyl]benzoic acid methyl ester Formula: C21H21NO5 MolecularWeight: 367.39514

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC2=C(C=C1)OCO2)C(=O)C=CC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CCN(CC1=CC2=C(C=C1)OCO2)C(=O)/C=C/C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C21H21NO5/c1-3-22(13-16-6-10-18-19(12-16)27-14-26-18)20(23)11-7-15-4-8-17(9-5-15)21(24)25-2/h4-12H,3,13-14H2,1-2H3/b11-7+