(3-bromanyl-4-cyclopentyloxy-5-methoxy-phenyl)methyl-(2-methylpropyl)azanium

Systemtic Name: (3-bromanyl-4-cyclopentyloxy-5-methoxy-phenyl)methyl-(2-methylpropyl)azanium Openeye Name: [3-bromo-4-(cyclopentoxy)-5-methoxy-phenyl]methyl-isobutyl-ammonium CAS Name: (3-bromo-4-cyclopentyloxy-5-methoxyphenyl)methyl-(2-methylpropyl)ammonium IUPAC Name: (3-bromo-4-cyclopentyloxy-5-methoxyphenyl)methyl-(2-methylpropyl)azanium Traditional Name: [3-bromo-4-(cyclopentoxy)-5-methoxy-benzyl]-isobutyl-ammonium Formula: C17H27BrNO2+ MolecularWeight: 357.30578

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[NH2+]CC1=CC(=C(C(=C1)Br)OC2CCCC2)OC

Isomeric SMILES

CC(C)C[NH2+]CC1=CC(=C(C(=C1)Br)OC2CCCC2)OC

InChI

InChI=1S/C17H26BrNO2/c1-12(2)10-19-11-13-8-15(18)17(16(9-13)20-3)21-14-6-4-5-7-14/h8-9,12,14,19H,4-7,10-11H2,1-3H3/p+1