propan-2-yl (E)-2-cyano-3-[4-(dimethylamino)-3-nitro-phenyl]prop-2-enoate

Systemtic Name: propan-2-yl (E)-2-cyano-3-[4-(dimethylamino)-3-nitro-phenyl]prop-2-enoate Openeye Name: isopropyl (E)-2-cyano-3-[4-(dimethylamino)-3-nitro-phenyl]prop-2-enoate CAS Name: (E)-2-cyano-3-[4-(dimethylamino)-3-nitrophenyl]-2-propenoic acid propan-2-yl ester IUPAC Name: propan-2-yl (E)-2-cyano-3-[4-(dimethylamino)-3-nitrophenyl]prop-2-enoate Traditional Name: (E)-2-cyano-3-[4-(dimethylamino)-3-nitro-phenyl]acrylic acid isopropyl ester Formula: C15H17N3O4 MolecularWeight: 303.31318

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C(=CC1=CC(=C(C=C1)N(C)C)[N+](=O)[O-])C#N

Isomeric SMILES

CC(C)OC(=O)/C(=C/C1=CC(=C(C=C1)N(C)C)[N+](=O)[O-])/C#N

InChI

InChI=1S/C15H17N3O4/c1-10(2)22-15(19)12(9-16)7-11-5-6-13(17(3)4)14(8-11)18(20)21/h5-8,10H,1-4H3/b12-7+