[(2S)-octan-2-yl]-(4-propan-2-yloxyphenyl)azanium

Systemtic Name: [(2S)-octan-2-yl]-(4-propan-2-yloxyphenyl)azanium Openeye Name: (4-isopropoxyphenyl)-[(1S)-1-methylheptyl]ammonium CAS Name: [(2S)-octan-2-yl]-(4-propan-2-yloxyphenyl)ammonium IUPAC Name: [(2S)-octan-2-yl]-(4-propan-2-yloxyphenyl)azanium Traditional Name: (4-isopropoxyphenyl)-[(1S)-1-methylheptyl]ammonium Formula: C17H30NO+ MolecularWeight: 264.4262

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)[NH2+]C1=CC=C(C=C1)OC(C)C

Isomeric SMILES

CCCCCC[C@H](C)[NH2+]C1=CC=C(C=C1)OC(C)C

InChI

InChI=1S/C17H29NO/c1-5-6-7-8-9-15(4)18-16-10-12-17(13-11-16)19-14(2)3/h10-15,18H,5-9H2,1-4H3/p+1/t15-/m0/s1