N-[3-chloranyl-2-[4-(4-methylphenyl)carbonylpiperazin-1-yl]phenyl]-2-(2-nitrophenoxy)ethanamide

Systemtic Name: N-[3-chloranyl-2-[4-(4-methylphenyl)carbonylpiperazin-1-yl]phenyl]-2-(2-nitrophenoxy)ethanamide Openeye Name: N-[3-chloro-2-[4-(4-methylbenzoyl)piperazin-1-yl]phenyl]-2-(2-nitrophenoxy)acetamide CAS Name: N-[3-chloro-2-[4-[(4-methylphenyl)-oxomethyl]-1-piperazinyl]phenyl]-2-(2-nitrophenoxy)acetamide IUPAC Name: N-[3-chloro-2-[4-(4-methylbenzoyl)piperazin-1-yl]phenyl]-2-(2-nitrophenoxy)acetamide Traditional Name: N-[3-chloro-2-(4-p-toluoylpiperazino)phenyl]-2-(2-nitrophenoxy)acetamide Formula: C26H25ClN4O5 MolecularWeight: 508.9535

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=CC=C3Cl)NC(=O)COC4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=CC=C3Cl)NC(=O)COC4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C26H25ClN4O5/c1-18-9-11-19(12-10-18)26(33)30-15-13-29(14-16-30)25-20(27)5-4-6-21(25)28-24(32)17-36-23-8-3-2-7-22(23)31(34)35/h2-12H,13-17H2,1H3,(H,28,32)