N-(3-butoxypropyl)-4-(4-ethanoylpiperazin-1-yl)-3-nitro-benzamide

Systemtic Name: N-(3-butoxypropyl)-4-(4-ethanoylpiperazin-1-yl)-3-nitro-benzamide Openeye Name: 4-(4-acetylpiperazin-1-yl)-N-(3-butoxypropyl)-3-nitro-benzamide CAS Name: 4-(4-acetyl-1-piperazinyl)-N-(3-butoxypropyl)-3-nitrobenzamide IUPAC Name: 4-(4-acetylpiperazin-1-yl)-N-(3-butoxypropyl)-3-nitrobenzamide Traditional Name: 4-(4-acetylpiperazino)-N-(3-butoxypropyl)-3-nitro-benzamide Formula: C20H30N4O5 MolecularWeight: 406.476

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCCCNC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C)[N+](=O)[O-]

Isomeric SMILES

CCCCOCCCNC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C20H30N4O5/c1-3-4-13-29-14-5-8-21-20(26)17-6-7-18(19(15-17)24(27)28)23-11-9-22(10-12-23)16(2)25/h6-7,15H,3-5,8-14H2,1-2H3,(H,21,26)