3-methylbutyl-[(1S)-1-(4-propoxyphenyl)ethyl]azanium

Systemtic Name: 3-methylbutyl-[(1S)-1-(4-propoxyphenyl)ethyl]azanium Openeye Name: isopentyl-[(1S)-1-(4-propoxyphenyl)ethyl]ammonium CAS Name: 3-methylbutyl-[(1S)-1-(4-propoxyphenyl)ethyl]ammonium IUPAC Name: 3-methylbutyl-[(1S)-1-(4-propoxyphenyl)ethyl]azanium Traditional Name: isoamyl-[(1S)-1-(4-propoxyphenyl)ethyl]ammonium Formula: C16H28NO+ MolecularWeight: 250.39962

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(C)[NH2+]CCC(C)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)[C@H](C)[NH2+]CCC(C)C

InChI

InChI=1S/C16H27NO/c1-5-12-18-16-8-6-15(7-9-16)14(4)17-11-10-13(2)3/h6-9,13-14,17H,5,10-12H2,1-4H3/p+1/t14-/m0/s1