propan-2-yl (E)-2-cyano-3-[1-(4-nitrophenyl)pyrrol-2-yl]prop-2-enoate

Systemtic Name: propan-2-yl (E)-2-cyano-3-[1-(4-nitrophenyl)pyrrol-2-yl]prop-2-enoate Openeye Name: isopropyl (E)-2-cyano-3-[1-(4-nitrophenyl)pyrrol-2-yl]prop-2-enoate CAS Name: (E)-2-cyano-3-[1-(4-nitrophenyl)-2-pyrrolyl]-2-propenoic acid propan-2-yl ester IUPAC Name: propan-2-yl (E)-2-cyano-3-[1-(4-nitrophenyl)pyrrol-2-yl]prop-2-enoate Traditional Name: (E)-2-cyano-3-[1-(4-nitrophenyl)pyrrol-2-yl]acrylic acid isopropyl ester Formula: C17H15N3O4 MolecularWeight: 325.3187

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C(=CC1=CC=CN1C2=CC=C(C=C2)[N+](=O)[O-])C#N

Isomeric SMILES

CC(C)OC(=O)/C(=C/C1=CC=CN1C2=CC=C(C=C2)[N+](=O)[O-])/C#N

InChI

InChI=1S/C17H15N3O4/c1-12(2)24-17(21)13(11-18)10-16-4-3-9-19(16)14-5-7-15(8-6-14)20(22)23/h3-10,12H,1-2H3/b13-10+