4-[4-(2-cyclohexylethyl)-1,4-diazepan-4-ium-1-yl]aniline

Systemtic Name: 4-[4-(2-cyclohexylethyl)-1,4-diazepan-4-ium-1-yl]aniline Openeye Name: 4-[4-(2-cyclohexylethyl)-1,4-diazepan-4-ium-1-yl]aniline CAS Name: 4-[4-(2-cyclohexylethyl)-1,4-diazepan-4-ium-1-yl]aniline IUPAC Name: 4-[4-(2-cyclohexylethyl)-1,4-diazepan-4-ium-1-yl]aniline Traditional Name: [4-[4-(2-cyclohexylethyl)-1,4-diazepan-4-ium-1-yl]phenyl]amine Formula: C19H32N3+ MolecularWeight: 302.47748

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC[NH+]2CCCN(CC2)C3=CC=C(C=C3)N

Isomeric SMILES

C1CCC(CC1)CC[NH+]2CCCN(CC2)C3=CC=C(C=C3)N

InChI

InChI=1S/C19H31N3/c20-18-7-9-19(10-8-18)22-13-4-12-21(15-16-22)14-11-17-5-2-1-3-6-17/h7-10,17H,1-6,11-16,20H2/p+1