(4-butoxyphenyl)methyl-[(1S,2R)-2-methylcyclohexyl]azanium

Systemtic Name: (4-butoxyphenyl)methyl-[(1S,2R)-2-methylcyclohexyl]azanium Openeye Name: (4-butoxyphenyl)methyl-[(1S,2R)-2-methylcyclohexyl]ammonium CAS Name: (4-butoxyphenyl)methyl-[(1S,2R)-2-methylcyclohexyl]ammonium IUPAC Name: (4-butoxyphenyl)methyl-[(1S,2R)-2-methylcyclohexyl]azanium Traditional Name: (4-butoxybenzyl)-[(1S,2R)-2-methylcyclohexyl]ammonium Formula: C18H30NO+ MolecularWeight: 276.4369

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C[NH2+]C2CCCCC2C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C[NH2+][C@H]2CCCC[C@H]2C

InChI

InChI=1S/C18H29NO/c1-3-4-13-20-17-11-9-16(10-12-17)14-19-18-8-6-5-7-15(18)2/h9-12,15,18-19H,3-8,13-14H2,1-2H3/p+1/t15-,18+/m1/s1