3-propan-2-yloxypropyl-[(1S)-1-(4-propoxyphenyl)ethyl]azanium

Systemtic Name: 3-propan-2-yloxypropyl-[(1S)-1-(4-propoxyphenyl)ethyl]azanium Openeye Name: 3-isopropoxypropyl-[(1S)-1-(4-propoxyphenyl)ethyl]ammonium CAS Name: 3-propan-2-yloxypropyl-[(1S)-1-(4-propoxyphenyl)ethyl]ammonium IUPAC Name: 3-propan-2-yloxypropyl-[(1S)-1-(4-propoxyphenyl)ethyl]azanium Traditional Name: 3-isopropoxypropyl-[(1S)-1-(4-propoxyphenyl)ethyl]ammonium Formula: C17H30NO2+ MolecularWeight: 280.4256

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H29NO2/c1-5-12-20-17-9-7-16(8-10-17)15(4)18-11-6-13-19-14(2)3/h7-10,14-15,18H,5-6,11-13H2,1-4H3/p+1/t15-/m0/s1