N-[4-[4-(5-chloranyl-2-methoxy-phenyl)carbonylpiperazin-1-yl]phenyl]-5-nitro-2-piperidin-1-yl-benzamide

Systemtic Name: N-[4-[4-(5-chloranyl-2-methoxy-phenyl)carbonylpiperazin-1-yl]phenyl]-5-nitro-2-piperidin-1-yl-benzamide Openeye Name: N-[4-[4-(5-chloro-2-methoxy-benzoyl)piperazin-1-yl]phenyl]-5-nitro-2-(1-piperidyl)benzamide CAS Name: N-[4-[4-[(5-chloro-2-methoxyphenyl)-oxomethyl]-1-piperazinyl]phenyl]-5-nitro-2-(1-piperidinyl)benzamide IUPAC Name: N-[4-[4-(5-chloro-2-methoxybenzoyl)piperazin-1-yl]phenyl]-5-nitro-2-piperidin-1-ylbenzamide Traditional Name: N-[4-[4-(5-chloro-2-methoxy-benzoyl)piperazino]phenyl]-5-nitro-2-piperidino-benzamide Formula: C30H32ClN5O5 MolecularWeight: 578.05858

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)C(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)C4=C(C=CC(=C4)[N+](=O)[O-])N5CCCCC5

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)C(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)C4=C(C=CC(=C4)[N+](=O)[O-])N5CCCCC5

InChI

InChI=1S/C30H32ClN5O5/c1-41-28-12-5-21(31)19-26(28)30(38)35-17-15-33(16-18-35)23-8-6-22(7-9-23)32-29(37)25-20-24(36(39)40)10-11-27(25)34-13-3-2-4-14-34/h5-12,19-20H,2-4,13-18H2,1H3,(H,32,37)