methyl 2-[[(E)-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)prop-2-enoyl]amino]-4,5-dimethoxy-benzoate

Systemtic Name: methyl 2-[[(E)-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)prop-2-enoyl]amino]-4,5-dimethoxy-benzoate Openeye Name: methyl 2-[[(E)-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)prop-2-enoyl]amino]-4,5-dimethoxy-benzoate CAS Name: 2-[[(E)-2-cyano-3-(2,5-dimethyl-1-propyl-3-pyrrolyl)-1-oxoprop-2-enyl]amino]-4,5-dimethoxybenzoic acid methyl ester IUPAC Name: methyl 2-[[(E)-2-cyano-3-(2,5-dimethyl-1-propylpyrrol-3-yl)prop-2-enoyl]amino]-4,5-dimethoxybenzoate Traditional Name: 2-[[(E)-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)acryloyl]amino]-4,5-dimethoxy-benzoic acid methyl ester Formula: C23H27N3O5 MolecularWeight: 425.47758

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CC(=C1C)C=C(C#N)C(=O)NC2=CC(=C(C=C2C(=O)OC)OC)OC)C

Isomeric SMILES

CCCN1C(=CC(=C1C)/C=C(\C#N)/C(=O)NC2=CC(=C(C=C2C(=O)OC)OC)OC)C

InChI

InChI=1S/C23H27N3O5/c1-7-8-26-14(2)9-16(15(26)3)10-17(13-24)22(27)25-19-12-21(30-5)20(29-4)11-18(19)23(28)31-6/h9-12H,7-8H2,1-6H3,(H,25,27)/b17-10+