ethyl 4-[[(Z)-3-[4-(dimethylamino)-2-nitro-phenyl]-2-methyl-prop-2-enoyl]amino]butanoate

Systemtic Name: ethyl 4-[[(Z)-3-[4-(dimethylamino)-2-nitro-phenyl]-2-methyl-prop-2-enoyl]amino]butanoate Openeye Name: ethyl 4-[[(Z)-3-[4-(dimethylamino)-2-nitro-phenyl]-2-methyl-prop-2-enoyl]amino]butanoate CAS Name: 4-[[(Z)-3-[4-(dimethylamino)-2-nitrophenyl]-2-methyl-1-oxoprop-2-enyl]amino]butanoic acid ethyl ester IUPAC Name: ethyl 4-[[(Z)-3-[4-(dimethylamino)-2-nitrophenyl]-2-methylprop-2-enoyl]amino]butanoate Traditional Name: 4-[[(Z)-3-[4-(dimethylamino)-2-nitro-phenyl]-2-methyl-acryloyl]amino]butyric acid ethyl ester Formula: C18H25N3O5 MolecularWeight: 363.4082

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCNC(=O)C(=CC1=C(C=C(C=C1)N(C)C)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)CCCNC(=O)/C(=C\C1=C(C=C(C=C1)N(C)C)[N+](=O)[O-])/C

InChI

InChI=1S/C18H25N3O5/c1-5-26-17(22)7-6-10-19-18(23)13(2)11-14-8-9-15(20(3)4)12-16(14)21(24)25/h8-9,11-12H,5-7,10H2,1-4H3,(H,19,23)/b13-11-