2-chloranyl-4-nitro-N-[4-[4-(phenylmethyl)piperidin-1-yl]-3-pyrrolidin-1-ylcarbonyl-phenyl]benzamide

Systemtic Name: 2-chloranyl-4-nitro-N-[4-[4-(phenylmethyl)piperidin-1-yl]-3-pyrrolidin-1-ylcarbonyl-phenyl]benzamide Openeye Name: N-[4-(4-benzyl-1-piperidyl)-3-(pyrrolidine-1-carbonyl)phenyl]-2-chloro-4-nitro-benzamide CAS Name: 2-chloro-4-nitro-N-[3-[oxo(1-pyrrolidinyl)methyl]-4-[4-(phenylmethyl)-1-piperidinyl]phenyl]benzamide IUPAC Name: N-[4-(4-benzylpiperidin-1-yl)-3-(pyrrolidine-1-carbonyl)phenyl]-2-chloro-4-nitrobenzamide Traditional Name: N-[4-(4-benzylpiperidino)-3-(pyrrolidine-1-carbonyl)phenyl]-2-chloro-4-nitro-benzamide Formula: C30H31ClN4O4 MolecularWeight: 547.04454

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=C(C=CC(=C2)NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl)N4CCC(CC4)CC5=CC=CC=C5

Isomeric SMILES

C1CCN(C1)C(=O)C2=C(C=CC(=C2)NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl)N4CCC(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C30H31ClN4O4/c31-27-20-24(35(38)39)9-10-25(27)29(36)32-23-8-11-28(26(19-23)30(37)34-14-4-5-15-34)33-16-12-22(13-17-33)18-21-6-2-1-3-7-21/h1-3,6-11,19-20,22H,4-5,12-18H2,(H,32,36)