2-(4-methylphenoxy)ethyl (E)-2-cyano-3-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)prop-2-enoate

Systemtic Name: 2-(4-methylphenoxy)ethyl (E)-2-cyano-3-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)prop-2-enoate Openeye Name: 2-(4-methylphenoxy)ethyl (E)-2-cyano-3-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)prop-2-enoate CAS Name: (E)-2-cyano-3-(1-cyclopropyl-2,5-dimethyl-3-pyrrolyl)-2-propenoic acid 2-(4-methylphenoxy)ethyl ester IUPAC Name: 2-(4-methylphenoxy)ethyl (E)-2-cyano-3-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)prop-2-enoate Traditional Name: (E)-2-cyano-3-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)acrylic acid 2-(4-methylphenoxy)ethyl ester Formula: C22H24N2O3 MolecularWeight: 364.43756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCCOC(=O)C(=CC2=C(N(C(=C2)C)C3CC3)C)C#N

Isomeric SMILES

CC1=CC=C(C=C1)OCCOC(=O)/C(=C/C2=C(N(C(=C2)C)C3CC3)C)/C#N

InChI

InChI=1S/C22H24N2O3/c1-15-4-8-21(9-5-15)26-10-11-27-22(25)19(14-23)13-18-12-16(2)24(17(18)3)20-6-7-20/h4-5,8-9,12-13,20H,6-7,10-11H2,1-3H3/b19-13+