2-azanyl-4-nitro-N-[2-oxidanylidene-1-phenyl-2-(4-piperidin-4-ylpiperidin-1-yl)ethyl]benzamide

Systemtic Name: 2-azanyl-4-nitro-N-[2-oxidanylidene-1-phenyl-2-(4-piperidin-4-ylpiperidin-1-yl)ethyl]benzamide Openeye Name: 2-amino-4-nitro-N-[2-oxo-1-phenyl-2-[4-(4-piperidyl)-1-piperidyl]ethyl]benzamide CAS Name: 2-amino-4-nitro-N-[2-oxo-1-phenyl-2-[4-(4-piperidinyl)-1-piperidinyl]ethyl]benzamide IUPAC Name: 2-amino-4-nitro-N-[2-oxo-1-phenyl-2-(4-piperidin-4-ylpiperidin-1-yl)ethyl]benzamide Traditional Name: 2-amino-N-[2-keto-1-phenyl-2-[4-(4-piperidyl)piperidino]ethyl]-4-nitro-benzamide Formula: C25H31N5O4 MolecularWeight: 465.54474

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C2CCN(CC2)C(=O)C(C3=CC=CC=C3)NC(=O)C4=C(C=C(C=C4)[N+](=O)[O-])N

Isomeric SMILES

C1CNCCC1C2CCN(CC2)C(=O)C(C3=CC=CC=C3)NC(=O)C4=C(C=C(C=C4)[N+](=O)[O-])N

InChI

InChI=1S/C25H31N5O4/c26-22-16-20(30(33)34)6-7-21(22)24(31)28-23(19-4-2-1-3-5-19)25(32)29-14-10-18(11-15-29)17-8-12-27-13-9-17/h1-7,16-18,23,27H,8-15,26H2,(H,28,31)