methyl (E)-3-[4-(4-acetyloxybutan-2-ylamino)-2-methyl-phenyl]-2-cyano-prop-2-enoate

Systemtic Name: methyl (E)-3-[4-(4-acetyloxybutan-2-ylamino)-2-methyl-phenyl]-2-cyano-prop-2-enoate Openeye Name: methyl (E)-3-[4-[(3-acetoxy-1-methyl-propyl)amino]-2-methyl-phenyl]-2-cyano-prop-2-enoate CAS Name: (E)-3-[4-(4-acetyloxybutan-2-ylamino)-2-methylphenyl]-2-cyano-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-[4-(4-acetyloxybutan-2-ylamino)-2-methylphenyl]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[4-[(3-acetoxy-1-methyl-propyl)amino]-2-methyl-phenyl]-2-cyano-acrylic acid methyl ester Formula: C18H22N2O4 MolecularWeight: 330.37828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(C)CCOC(=O)C)C=C(C#N)C(=O)OC

Isomeric SMILES

CC1=C(C=CC(=C1)NC(C)CCOC(=O)C)/C=C(\C#N)/C(=O)OC

InChI

InChI=1S/C18H22N2O4/c1-12-9-17(20-13(2)7-8-24-14(3)21)6-5-15(12)10-16(11-19)18(22)23-4/h5-6,9-10,13,20H,7-8H2,1-4H3/b16-10+