butyl-[(3-chloranyl-4-phenylmethoxy-phenyl)methyl]azanium

Systemtic Name: butyl-[(3-chloranyl-4-phenylmethoxy-phenyl)methyl]azanium Openeye Name: (4-benzyloxy-3-chloro-phenyl)methyl-butyl-ammonium CAS Name: butyl-[(3-chloro-4-phenylmethoxyphenyl)methyl]ammonium IUPAC Name: butyl-[(3-chloro-4-phenylmethoxyphenyl)methyl]azanium Traditional Name: (4-benzoxy-3-chloro-benzyl)-butyl-ammonium Formula: C18H23ClNO+ MolecularWeight: 304.83432

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH2+]CC1=CC(=C(C=C1)OCC2=CC=CC=C2)Cl

Isomeric SMILES

CCCC[NH2+]CC1=CC(=C(C=C1)OCC2=CC=CC=C2)Cl

InChI

InChI=1S/C18H22ClNO/c1-2-3-11-20-13-16-9-10-18(17(19)12-16)21-14-15-7-5-4-6-8-15/h4-10,12,20H,2-3,11,13-14H2,1H3/p+1