[4-(azepan-1-yl)-2-(2-ethylhexoxy)phenyl]iminoazanium

Systemtic Name: [4-(azepan-1-yl)-2-(2-ethylhexoxy)phenyl]iminoazanium Openeye Name: [4-(azepan-1-yl)-2-(2-ethylhexoxy)phenyl]iminoammonium CAS Name: [4-(1-azepanyl)-2-(2-ethylhexoxy)phenyl]iminoammonium IUPAC Name: [4-(azepan-1-yl)-2-(2-ethylhexoxy)phenyl]iminoazanium Traditional Name: [4-(azepan-1-yl)-2-(2-ethylhexoxy)phenyl]iminoammonium Formula: C20H34N3O+ MolecularWeight: 332.50346

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC1=C(C=CC(=C1)N2CCCCCC2)N=[NH2+]

Isomeric SMILES

CCCCC(CC)COC1=C(C=CC(=C1)N2CCCCCC2)N=[NH2+]

InChI

InChI=1S/C20H33N3O/c1-3-5-10-17(4-2)16-24-20-15-18(11-12-19(20)22-21)23-13-8-6-7-9-14-23/h11-12,15,17,21H,3-10,13-14,16H2,1-2H3/p+1