N-[4-[4-[2-(4-methoxyphenyl)ethanoyl]piperazin-1-yl]phenyl]-4-methyl-3-nitro-benzamide

Systemtic Name: N-[4-[4-[2-(4-methoxyphenyl)ethanoyl]piperazin-1-yl]phenyl]-4-methyl-3-nitro-benzamide Openeye Name: N-[4-[4-[2-(4-methoxyphenyl)acetyl]piperazin-1-yl]phenyl]-4-methyl-3-nitro-benzamide CAS Name: N-[4-[4-[2-(4-methoxyphenyl)-1-oxoethyl]-1-piperazinyl]phenyl]-4-methyl-3-nitrobenzamide IUPAC Name: N-[4-[4-[2-(4-methoxyphenyl)acetyl]piperazin-1-yl]phenyl]-4-methyl-3-nitrobenzamide Traditional Name: N-[4-[4-[2-(4-methoxyphenyl)acetyl]piperazino]phenyl]-4-methyl-3-nitro-benzamide Formula: C27H28N4O5 MolecularWeight: 488.53502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)CC4=CC=C(C=C4)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)CC4=CC=C(C=C4)OC)[N+](=O)[O-]

InChI

InChI=1S/C27H28N4O5/c1-19-3-6-21(18-25(19)31(34)35)27(33)28-22-7-9-23(10-8-22)29-13-15-30(16-14-29)26(32)17-20-4-11-24(36-2)12-5-20/h3-12,18H,13-17H2,1-2H3,(H,28,33)