4-(4-phenethyl-1,4-diazepan-4-ium-1-yl)aniline

Systemtic Name: 4-(4-phenethyl-1,4-diazepan-4-ium-1-yl)aniline Openeye Name: 4-(4-phenethyl-1,4-diazepan-4-ium-1-yl)aniline CAS Name: 4-(4-phenethyl-1,4-diazepan-4-ium-1-yl)aniline IUPAC Name: 4-(4-phenethyl-1,4-diazepan-4-ium-1-yl)aniline Traditional Name: [4-(4-phenethyl-1,4-diazepan-4-ium-1-yl)phenyl]amine Formula: C19H26N3+ MolecularWeight: 296.42984

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCN(C1)C2=CC=C(C=C2)N)CCC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CCN(C1)C2=CC=C(C=C2)N)CCC3=CC=CC=C3

InChI

InChI=1S/C19H25N3/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/h1-3,5-10H,4,11-16,20H2/p+1