2-chloranyl-N-[(2S)-1-[4-(4-nitrophenyl)piperazin-1-yl]-1-oxidanylidene-propan-2-yl]benzamide

Systemtic Name: 2-chloranyl-N-[(2S)-1-[4-(4-nitrophenyl)piperazin-1-yl]-1-oxidanylidene-propan-2-yl]benzamide Openeye Name: 2-chloro-N-[(1S)-1-methyl-2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxo-ethyl]benzamide CAS Name: 2-chloro-N-[(2S)-1-[4-(4-nitrophenyl)-1-piperazinyl]-1-oxopropan-2-yl]benzamide IUPAC Name: 2-chloro-N-[(2S)-1-[4-(4-nitrophenyl)piperazin-1-yl]-1-oxopropan-2-yl]benzamide Traditional Name: 2-chloro-N-[(1S)-2-keto-1-methyl-2-[4-(4-nitrophenyl)piperazino]ethyl]benzamide Formula: C20H21ClN4O4 MolecularWeight: 416.85814

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C2=CC=C(C=C2)[N+](=O)[O-])NC(=O)C3=CC=CC=C3Cl

Isomeric SMILES

C[C@@H](C(=O)N1CCN(CC1)C2=CC=C(C=C2)[N+](=O)[O-])NC(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C20H21ClN4O4/c1-14(22-19(26)17-4-2-3-5-18(17)21)20(27)24-12-10-23(11-13-24)15-6-8-16(9-7-15)25(28)29/h2-9,14H,10-13H2,1H3,(H,22,26)/t14-/m0/s1