5-[[4-[ethyl-(4-nitrophenyl)imino-azaniumyl]phenyl]amino]-2-methylidene-pentanoate

Systemtic Name: 5-[[4-[ethyl-(4-nitrophenyl)imino-azaniumyl]phenyl]amino]-2-methylidene-pentanoate Openeye Name: 5-[4-[ethyl-(4-nitrophenyl)imino-ammonio]anilino]-2-methylene-pentanoate CAS Name: 5-[4-[ethyl-(4-nitrophenyl)iminoammonio]anilino]-2-methylenepentanoate IUPAC Name: 5-[4-[ethyl-(4-nitrophenyl)iminoazaniumyl]anilino]-2-methylidenepentanoate Traditional Name: 2-[3-[4-[ethyl-(4-nitrophenyl)imino-ammonio]anilino]propyl]acrylate Formula: C20H22N4O4 MolecularWeight: 382.41308

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](=NC1=CC=C(C=C1)[N+](=O)[O-])C2=CC=C(C=C2)NCCCC(=C)C(=O)[O-]

Isomeric SMILES

CC[N+](=NC1=CC=C(C=C1)[N+](=O)[O-])C2=CC=C(C=C2)NCCCC(=C)C(=O)[O-]

InChI

InChI=1S/C20H22N4O4/c1-3-23(22-17-8-12-19(13-9-17)24(27)28)18-10-6-16(7-11-18)21-14-4-5-15(2)20(25)26/h6-13H,2-5,14H2,1H3,(H-,21,22,25,26)