3-butoxypropyl-[(3-chloranyl-4,5-dimethoxy-phenyl)methyl]azanium

Systemtic Name: 3-butoxypropyl-[(3-chloranyl-4,5-dimethoxy-phenyl)methyl]azanium Openeye Name: 3-butoxypropyl-[(3-chloro-4,5-dimethoxy-phenyl)methyl]ammonium CAS Name: 3-butoxypropyl-[(3-chloro-4,5-dimethoxyphenyl)methyl]ammonium IUPAC Name: 3-butoxypropyl-[(3-chloro-4,5-dimethoxyphenyl)methyl]azanium Traditional Name: 3-butoxypropyl-(3-chloro-4,5-dimethoxy-benzyl)ammonium Formula: C16H27ClNO3+ MolecularWeight: 316.84348

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCCC[NH2+]CC1=CC(=C(C(=C1)Cl)OC)OC

Isomeric SMILES

CCCCOCCC[NH2+]CC1=CC(=C(C(=C1)Cl)OC)OC

InChI

InChI=1S/C16H26ClNO3/c1-4-5-8-21-9-6-7-18-12-13-10-14(17)16(20-3)15(11-13)19-2/h10-11,18H,4-9,12H2,1-3H3/p+1