2-chloranyl-N-[3-chloranyl-4-[4-(4-propoxyphenyl)carbonylpiperazin-1-yl]phenyl]-4-nitro-benzamide

Systemtic Name: 2-chloranyl-N-[3-chloranyl-4-[4-(4-propoxyphenyl)carbonylpiperazin-1-yl]phenyl]-4-nitro-benzamide Openeye Name: 2-chloro-N-[3-chloro-4-[4-(4-propoxybenzoyl)piperazin-1-yl]phenyl]-4-nitro-benzamide CAS Name: 2-chloro-N-[3-chloro-4-[4-[oxo-(4-propoxyphenyl)methyl]-1-piperazinyl]phenyl]-4-nitrobenzamide IUPAC Name: 2-chloro-N-[3-chloro-4-[4-(4-propoxybenzoyl)piperazin-1-yl]phenyl]-4-nitrobenzamide Traditional Name: 2-chloro-N-[3-chloro-4-[4-(4-propoxybenzoyl)piperazino]phenyl]-4-nitro-benzamide Formula: C27H26Cl2N4O5 MolecularWeight: 557.42514

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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)C4=C(C=C(C=C4)[N+](=O)[O-])Cl)Cl

Isomeric SMILES

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

InChI

InChI=1S/C27H26Cl2N4O5/c1-2-15-38-21-7-3-18(4-8-21)27(35)32-13-11-31(12-14-32)25-10-5-19(16-24(25)29)30-26(34)22-9-6-20(33(36)37)17-23(22)28/h3-10,16-17H,2,11-15H2,1H3,(H,30,34)