[(2S)-2-(3-methoxy-4-propoxy-phenyl)-2-oxidanyl-propyl]-(2-methylpropyl)azanium

Systemtic Name: [(2S)-2-(3-methoxy-4-propoxy-phenyl)-2-oxidanyl-propyl]-(2-methylpropyl)azanium Openeye Name: [(2S)-2-hydroxy-2-(3-methoxy-4-propoxy-phenyl)propyl]-isobutyl-ammonium CAS Name: [(2S)-2-hydroxy-2-(3-methoxy-4-propoxyphenyl)propyl]-(2-methylpropyl)ammonium IUPAC Name: [(2S)-2-hydroxy-2-(3-methoxy-4-propoxyphenyl)propyl]-(2-methylpropyl)azanium Traditional Name: [(2S)-2-hydroxy-2-(3-methoxy-4-propoxy-phenyl)propyl]-isobutyl-ammonium Formula: C17H30NO3+ MolecularWeight: 296.425

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(C)(C[NH2+]CC(C)C)O)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)[C@@](C)(C[NH2+]CC(C)C)O)OC

InChI

InChI=1S/C17H29NO3/c1-6-9-21-15-8-7-14(10-16(15)20-5)17(4,19)12-18-11-13(2)3/h7-8,10,13,18-19H,6,9,11-12H2,1-5H3/p+1/t17-/m1/s1