ethyl 4-[(2E)-2-[[4-(4-methylpiperidin-1-yl)-3-nitro-phenyl]methylidene]hydrazinyl]benzoate

Systemtic Name: ethyl 4-[(2E)-2-[[4-(4-methylpiperidin-1-yl)-3-nitro-phenyl]methylidene]hydrazinyl]benzoate Openeye Name: ethyl 4-[(2E)-2-[[4-(4-methyl-1-piperidyl)-3-nitro-phenyl]methylene]hydrazino]benzoate CAS Name: 4-[(2E)-2-[[4-(4-methyl-1-piperidinyl)-3-nitrophenyl]methylidene]hydrazinyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(2E)-2-[[4-(4-methylpiperidin-1-yl)-3-nitrophenyl]methylidene]hydrazinyl]benzoate Traditional Name: 4-[(N'E)-N'-[4-(4-methylpiperidino)-3-nitro-benzylidene]hydrazino]benzoic acid ethyl ester Formula: C22H26N4O4 MolecularWeight: 410.46624

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NN=CC2=CC(=C(C=C2)N3CCC(CC3)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N/N=C/C2=CC(=C(C=C2)N3CCC(CC3)C)[N+](=O)[O-]

InChI

InChI=1S/C22H26N4O4/c1-3-30-22(27)18-5-7-19(8-6-18)24-23-15-17-4-9-20(21(14-17)26(28)29)25-12-10-16(2)11-13-25/h4-9,14-16,24H,3,10-13H2,1-2H3/b23-15+