[4-[(3-nitrophenyl)methyl]piperazin-1-yl]-[1-(pyridin-4-ylmethyl)piperidin-4-yl]methanone

Systemtic Name: [4-[(3-nitrophenyl)methyl]piperazin-1-yl]-[1-(pyridin-4-ylmethyl)piperidin-4-yl]methanone Openeye Name: [4-[(3-nitrophenyl)methyl]piperazin-1-yl]-[1-(4-pyridylmethyl)-4-piperidyl]methanone CAS Name: [4-[(3-nitrophenyl)methyl]-1-piperazinyl]-[1-(pyridin-4-ylmethyl)-4-piperidinyl]methanone IUPAC Name: [4-[(3-nitrophenyl)methyl]piperazin-1-yl]-[1-(pyridin-4-ylmethyl)piperidin-4-yl]methanone Traditional Name: [4-(3-nitrobenzyl)piperazino]-[1-(4-pyridylmethyl)-4-piperidyl]methanone Formula: C23H29N5O3 MolecularWeight: 423.50806

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N2CCN(CC2)CC3=CC(=CC=C3)[N+](=O)[O-])CC4=CC=NC=C4

Isomeric SMILES

C1CN(CCC1C(=O)N2CCN(CC2)CC3=CC(=CC=C3)[N+](=O)[O-])CC4=CC=NC=C4

InChI

InChI=1S/C23H29N5O3/c29-23(21-6-10-25(11-7-21)17-19-4-8-24-9-5-19)27-14-12-26(13-15-27)18-20-2-1-3-22(16-20)28(30)31/h1-5,8-9,16,21H,6-7,10-15,17-18H2