1-(2-methoxy-5-methyl-phenyl)-3-[2-[1-(4-nitrophenyl)piperidin-4-ylidene]ethanoylamino]urea

Systemtic Name: 1-(2-methoxy-5-methyl-phenyl)-3-[2-[1-(4-nitrophenyl)piperidin-4-ylidene]ethanoylamino]urea Openeye Name: 1-(2-methoxy-5-methyl-phenyl)-3-[[2-[1-(4-nitrophenyl)-4-piperidylidene]acetyl]amino]urea CAS Name: 1-(2-methoxy-5-methylphenyl)-3-[[2-[1-(4-nitrophenyl)-4-piperidinylidene]-1-oxoethyl]amino]urea IUPAC Name: 1-(2-methoxy-5-methylphenyl)-3-[[2-[1-(4-nitrophenyl)piperidin-4-ylidene]acetyl]amino]urea Traditional Name: 1-(2-methoxy-5-methyl-phenyl)-3-[[2-[1-(4-nitrophenyl)-4-piperidylidene]acetyl]amino]urea Formula: C22H25N5O5 MolecularWeight: 439.4644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)NNC(=O)C=C2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)NNC(=O)C=C2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H25N5O5/c1-15-3-8-20(32-2)19(13-15)23-22(29)25-24-21(28)14-16-9-11-26(12-10-16)17-4-6-18(7-5-17)27(30)31/h3-8,13-14H,9-12H2,1-2H3,(H,24,28)(H2,23,25,29)