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

Systemtic Name: N-[2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-4-methoxy-3-nitro-benzamide Openeye Name: N-[2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxo-ethyl]-4-methoxy-3-nitro-benzamide CAS Name: N-[2-[4-(3-chlorophenyl)-1-piperazinyl]-2-oxoethyl]-4-methoxy-3-nitrobenzamide IUPAC Name: N-[2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxoethyl]-4-methoxy-3-nitrobenzamide Traditional Name: N-[2-[4-(3-chlorophenyl)piperazino]-2-keto-ethyl]-4-methoxy-3-nitro-benzamide Formula: C20H21ClN4O5 MolecularWeight: 432.85754

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21ClN4O5/c1-30-18-6-5-14(11-17(18)25(28)29)20(27)22-13-19(26)24-9-7-23(8-10-24)16-4-2-3-15(21)12-16/h2-6,11-12H,7-10,13H2,1H3,(H,22,27)