4-(4-ethanoylpiperazin-1-yl)-N-[(1S)-1-(2-methoxyphenyl)ethyl]-3-nitro-benzamide

Systemtic Name: 4-(4-ethanoylpiperazin-1-yl)-N-[(1S)-1-(2-methoxyphenyl)ethyl]-3-nitro-benzamide Openeye Name: 4-(4-acetylpiperazin-1-yl)-N-[(1S)-1-(2-methoxyphenyl)ethyl]-3-nitro-benzamide CAS Name: 4-(4-acetyl-1-piperazinyl)-N-[(1S)-1-(2-methoxyphenyl)ethyl]-3-nitrobenzamide IUPAC Name: 4-(4-acetylpiperazin-1-yl)-N-[(1S)-1-(2-methoxyphenyl)ethyl]-3-nitrobenzamide Traditional Name: 4-(4-acetylpiperazino)-N-[(1S)-1-(2-methoxyphenyl)ethyl]-3-nitro-benzamide Formula: C22H26N4O5 MolecularWeight: 426.46564

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1OC)NC(=O)C2=CC(=C(C=C2)N3CCN(CC3)C(=O)C)[N+](=O)[O-]

Isomeric SMILES

C[C@@H](C1=CC=CC=C1OC)NC(=O)C2=CC(=C(C=C2)N3CCN(CC3)C(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C22H26N4O5/c1-15(18-6-4-5-7-21(18)31-3)23-22(28)17-8-9-19(20(14-17)26(29)30)25-12-10-24(11-13-25)16(2)27/h4-9,14-15H,10-13H2,1-3H3,(H,23,28)/t15-/m0/s1