3-[[2,6-dimethyl-4-(3-nitrophenyl)phenoxy]methyl]-1-methyl-piperidine

Systemtic Name: 3-[[2,6-dimethyl-4-(3-nitrophenyl)phenoxy]methyl]-1-methyl-piperidine Openeye Name: 3-[[2,6-dimethyl-4-(3-nitrophenyl)phenoxy]methyl]-1-methyl-piperidine CAS Name: 3-[[2,6-dimethyl-4-(3-nitrophenyl)phenoxy]methyl]-1-methylpiperidine IUPAC Name: 3-[[2,6-dimethyl-4-(3-nitrophenyl)phenoxy]methyl]-1-methylpiperidine Traditional Name: 3-[[2,6-dimethyl-4-(3-nitrophenyl)phenoxy]methyl]-1-methyl-piperidine Formula: C21H26N2O3 MolecularWeight: 354.44274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC2CCCN(C2)C)C)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1OCC2CCCN(C2)C)C)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H26N2O3/c1-15-10-19(18-7-4-8-20(12-18)23(24)25)11-16(2)21(15)26-14-17-6-5-9-22(3)13-17/h4,7-8,10-12,17H,5-6,9,13-14H2,1-3H3