4-methyl-3-nitro-N-[2-oxidanylidene-2-[4-(2-phenoxyethyl)piperazin-1-yl]ethyl]benzamide

Systemtic Name: 4-methyl-3-nitro-N-[2-oxidanylidene-2-[4-(2-phenoxyethyl)piperazin-1-yl]ethyl]benzamide Openeye Name: 4-methyl-3-nitro-N-[2-oxo-2-[4-(2-phenoxyethyl)piperazin-1-yl]ethyl]benzamide CAS Name: 4-methyl-3-nitro-N-[2-oxo-2-[4-(2-phenoxyethyl)-1-piperazinyl]ethyl]benzamide IUPAC Name: 4-methyl-3-nitro-N-[2-oxo-2-[4-(2-phenoxyethyl)piperazin-1-yl]ethyl]benzamide Traditional Name: N-[2-keto-2-[4-(2-phenoxyethyl)piperazino]ethyl]-4-methyl-3-nitro-benzamide Formula: C22H26N4O5 MolecularWeight: 426.46564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCC(=O)N2CCN(CC2)CCOC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCC(=O)N2CCN(CC2)CCOC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H26N4O5/c1-17-7-8-18(15-20(17)26(29)30)22(28)23-16-21(27)25-11-9-24(10-12-25)13-14-31-19-5-3-2-4-6-19/h2-8,15H,9-14,16H2,1H3,(H,23,28)