4-[[3-(3-isocyanophenyl)-5-propyl-phenyl]methoxymethyl]-1-methyl-piperidine

Systemtic Name: 4-[[3-(3-isocyanophenyl)-5-propyl-phenyl]methoxymethyl]-1-methyl-piperidine Openeye Name: 4-[[3-(3-isocyanophenyl)-5-propyl-phenyl]methoxymethyl]-1-methyl-piperidine CAS Name: 4-[[3-(3-isocyanophenyl)-5-propylphenyl]methoxymethyl]-1-methylpiperidine IUPAC Name: 4-[[3-(3-isocyanophenyl)-5-propylphenyl]methoxymethyl]-1-methylpiperidine Traditional Name: 4-[[3-(3-isocyanophenyl)-5-propyl-benzyl]oxymethyl]-1-methyl-piperidine Formula: C24H30N2O MolecularWeight: 362.5078

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=CC(=C1)C2=CC(=CC=C2)[N+]#[C-])COCC3CCN(CC3)C

Isomeric SMILES

CCCC1=CC(=CC(=C1)C2=CC(=CC=C2)[N+]#[C-])COCC3CCN(CC3)C

InChI

InChI=1S/C24H30N2O/c1-4-6-20-13-21(18-27-17-19-9-11-26(3)12-10-19)15-23(14-20)22-7-5-8-24(16-22)25-2/h5,7-8,13-16,19H,4,6,9-12,17-18H2,1,3H3