4-[[[4-(aminomethyl)cyclohexyl]methyl-(2-ethylbutyl)amino]methyl]benzenecarbonitrile

Systemtic Name: 4-[[[4-(aminomethyl)cyclohexyl]methyl-(2-ethylbutyl)amino]methyl]benzenecarbonitrile Openeye Name: 4-[[[4-(aminomethyl)cyclohexyl]methyl-(2-ethylbutyl)amino]methyl]benzonitrile CAS Name: 4-[[[4-(aminomethyl)cyclohexyl]methyl-(2-ethylbutyl)amino]methyl]benzonitrile IUPAC Name: 4-[[[4-(aminomethyl)cyclohexyl]methyl-(2-ethylbutyl)amino]methyl]benzonitrile Traditional Name: 4-[[[4-(aminomethyl)cyclohexyl]methyl-(2-ethylbutyl)amino]methyl]benzonitrile Formula: C22H35N3 MolecularWeight: 341.5334

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)CN(CC1CCC(CC1)CN)CC2=CC=C(C=C2)C#N

Isomeric SMILES

CCC(CC)CN(CC1CCC(CC1)CN)CC2=CC=C(C=C2)C#N

InChI

InChI=1S/C22H35N3/c1-3-18(4-2)15-25(16-21-9-5-19(13-23)6-10-21)17-22-11-7-20(14-24)8-12-22/h5-6,9-10,18,20,22H,3-4,7-8,11-12,14-17,24H2,1-2H3