N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]-3-oxidanylidene-propyl]-4-nitro-benzamide

Systemtic Name: N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]-3-oxidanylidene-propyl]-4-nitro-benzamide Openeye Name: N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]-3-oxo-propyl]-4-nitro-benzamide CAS Name: N-[3-[4-(4-methoxyphenyl)-1-piperazinyl]-3-oxopropyl]-4-nitrobenzamide IUPAC Name: N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]-3-oxopropyl]-4-nitrobenzamide Traditional Name: N-[3-keto-3-[4-(4-methoxyphenyl)piperazino]propyl]-4-nitro-benzamide Formula: C21H24N4O5 MolecularWeight: 412.43906

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)CCNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)CCNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H24N4O5/c1-30-19-8-6-17(7-9-19)23-12-14-24(15-13-23)20(26)10-11-22-21(27)16-2-4-18(5-3-16)25(28)29/h2-9H,10-15H2,1H3,(H,22,27)