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

Systemtic Name: N-[3-[4-(3-chlorophenyl)piperazin-1-yl]-3-oxidanylidene-propyl]-4-nitro-benzamide Openeye Name: N-[3-[4-(3-chlorophenyl)piperazin-1-yl]-3-oxo-propyl]-4-nitro-benzamide CAS Name: N-[3-[4-(3-chlorophenyl)-1-piperazinyl]-3-oxopropyl]-4-nitrobenzamide IUPAC Name: N-[3-[4-(3-chlorophenyl)piperazin-1-yl]-3-oxopropyl]-4-nitrobenzamide Traditional Name: N-[3-[4-(3-chlorophenyl)piperazino]-3-keto-propyl]-4-nitro-benzamide Formula: C20H21ClN4O4 MolecularWeight: 416.85814

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC=C2)Cl)C(=O)CCNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC(=CC=C2)Cl)C(=O)CCNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H21ClN4O4/c21-16-2-1-3-18(14-16)23-10-12-24(13-11-23)19(26)8-9-22-20(27)15-4-6-17(7-5-15)25(28)29/h1-7,14H,8-13H2,(H,22,27)