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

Systemtic Name: N-[3-chloranyl-4-[4-(4-propoxyphenyl)carbonylpiperazin-1-yl]phenyl]-2-(4-nitrophenoxy)ethanamide Openeye Name: N-[3-chloro-4-[4-(4-propoxybenzoyl)piperazin-1-yl]phenyl]-2-(4-nitrophenoxy)acetamide CAS Name: N-[3-chloro-4-[4-[oxo-(4-propoxyphenyl)methyl]-1-piperazinyl]phenyl]-2-(4-nitrophenoxy)acetamide IUPAC Name: N-[3-chloro-4-[4-(4-propoxybenzoyl)piperazin-1-yl]phenyl]-2-(4-nitrophenoxy)acetamide Traditional Name: N-[3-chloro-4-[4-(4-propoxybenzoyl)piperazino]phenyl]-2-(4-nitrophenoxy)acetamide Formula: C28H29ClN4O6 MolecularWeight: 553.00606

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)NC(=O)COC4=CC=C(C=C4)[N+](=O)[O-])Cl

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)NC(=O)COC4=CC=C(C=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C28H29ClN4O6/c1-2-17-38-23-8-3-20(4-9-23)28(35)32-15-13-31(14-16-32)26-12-5-21(18-25(26)29)30-27(34)19-39-24-10-6-22(7-11-24)33(36)37/h3-12,18H,2,13-17,19H2,1H3,(H,30,34)