4-methyl-N-[2-[6-(4-methylpiperidin-1-yl)pyrimidin-4-yl]oxyethyl]-3-nitro-benzamide

Systemtic Name: 4-methyl-N-[2-[6-(4-methylpiperidin-1-yl)pyrimidin-4-yl]oxyethyl]-3-nitro-benzamide Openeye Name: 4-methyl-N-[2-[6-(4-methyl-1-piperidyl)pyrimidin-4-yl]oxyethyl]-3-nitro-benzamide CAS Name: 4-methyl-N-[2-[[6-(4-methyl-1-piperidinyl)-4-pyrimidinyl]oxy]ethyl]-3-nitrobenzamide IUPAC Name: 4-methyl-N-[2-[6-(4-methylpiperidin-1-yl)pyrimidin-4-yl]oxyethyl]-3-nitrobenzamide Traditional Name: 4-methyl-N-[2-[6-(4-methylpiperidino)pyrimidin-4-yl]oxyethyl]-3-nitro-benzamide Formula: C20H25N5O4 MolecularWeight: 399.4436

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=CC(=NC=N2)OCCNC(=O)C3=CC(=C(C=C3)C)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C2=CC(=NC=N2)OCCNC(=O)C3=CC(=C(C=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C20H25N5O4/c1-14-5-8-24(9-6-14)18-12-19(23-13-22-18)29-10-7-21-20(26)16-4-3-15(2)17(11-16)25(27)28/h3-4,11-14H,5-10H2,1-2H3,(H,21,26)