N4-(1,3-benzodioxol-5-ylmethyl)-N4-[(3-phenoxyphenyl)methyl]cyclohexane-1,4-diamine

Systemtic Name: N4-(1,3-benzodioxol-5-ylmethyl)-N4-[(3-phenoxyphenyl)methyl]cyclohexane-1,4-diamine Openeye Name: N4-(1,3-benzodioxol-5-ylmethyl)-N4-[(3-phenoxyphenyl)methyl]cyclohexane-1,4-diamine CAS Name: N4-(1,3-benzodioxol-5-ylmethyl)-N4-[(3-phenoxyphenyl)methyl]cyclohexane-1,4-diamine IUPAC Name: 4-N-(1,3-benzodioxol-5-ylmethyl)-4-N-[(3-phenoxyphenyl)methyl]cyclohexane-1,4-diamine Traditional Name: (4-aminocyclohexyl)-(3-phenoxybenzyl)-piperonyl-amine Formula: C27H30N2O3 MolecularWeight: 430.5387

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N)N(CC2=CC(=CC=C2)OC3=CC=CC=C3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CC(CCC1N)N(CC2=CC(=CC=C2)OC3=CC=CC=C3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C27H30N2O3/c28-22-10-12-23(13-11-22)29(18-21-9-14-26-27(16-21)31-19-30-26)17-20-5-4-8-25(15-20)32-24-6-2-1-3-7-24/h1-9,14-16,22-23H,10-13,17-19,28H2