4-(4-ethanoylpiperazin-1-yl)-3-nitro-N-(3-propan-2-yloxypropyl)benzamide

Systemtic Name: 4-(4-ethanoylpiperazin-1-yl)-3-nitro-N-(3-propan-2-yloxypropyl)benzamide Openeye Name: 4-(4-acetylpiperazin-1-yl)-N-(3-isopropoxypropyl)-3-nitro-benzamide CAS Name: 4-(4-acetyl-1-piperazinyl)-3-nitro-N-(3-propan-2-yloxypropyl)benzamide IUPAC Name: 4-(4-acetylpiperazin-1-yl)-3-nitro-N-(3-propan-2-yloxypropyl)benzamide Traditional Name: 4-(4-acetylpiperazino)-N-(3-isopropoxypropyl)-3-nitro-benzamide Formula: C19H28N4O5 MolecularWeight: 392.44942

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H28N4O5/c1-14(2)28-12-4-7-20-19(25)16-5-6-17(18(13-16)23(26)27)22-10-8-21(9-11-22)15(3)24/h5-6,13-14H,4,7-12H2,1-3H3,(H,20,25)