N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]-2-(4-methylpiperidin-1-yl)-5-nitro-benzamide

Systemtic Name: N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]-2-(4-methylpiperidin-1-yl)-5-nitro-benzamide Openeye Name: N-[4-methoxy-3-(4-pyridylmethoxy)phenyl]-2-(4-methyl-1-piperidyl)-5-nitro-benzamide CAS Name: N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]-2-(4-methyl-1-piperidinyl)-5-nitrobenzamide IUPAC Name: N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]-2-(4-methylpiperidin-1-yl)-5-nitrobenzamide Traditional Name: N-[4-methoxy-3-(4-pyridylmethoxy)phenyl]-2-(4-methylpiperidino)-5-nitro-benzamide Formula: C26H28N4O5 MolecularWeight: 476.52432

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC(=C(C=C3)OC)OCC4=CC=NC=C4

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC(=C(C=C3)OC)OCC4=CC=NC=C4

InChI

InChI=1S/C26H28N4O5/c1-18-9-13-29(14-10-18)23-5-4-21(30(32)33)16-22(23)26(31)28-20-3-6-24(34-2)25(15-20)35-17-19-7-11-27-12-8-19/h3-8,11-12,15-16,18H,9-10,13-14,17H2,1-2H3,(H,28,31)