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3-[[[4-(aminomethyl)cyclohexyl]methyl-[(3-methoxyphenyl)methyl]amino]methyl]benzenecarbonitrile
3-[[[4-(aminomethyl)cyclohexyl]methyl-[(3-methoxyphenyl)methyl]amino]methyl]benzenecarbonitrile
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Descriptors Computed from Structure
Canonical SMILES:
COC1=CC=CC(=C1)CN(CC2CCC(CC2)CN)CC3=CC=CC(=C3)C#N
Isomeric SMILES
COC1=CC=CC(=C1)CN(CC2CCC(CC2)CN)CC3=CC=CC(=C3)C#N
InChI
InChI=1S/C24H31N3O/c1-28-24-7-3-6-23(13-24)18-27(16-20-10-8-19(14-25)9-11-20)17-22-5-2-4-21(12-22)15-26/h2-7,12-13,19-20H,8-11,14,16-18,25H2,1H3
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