[(2S)-2-(4-butoxy-3-methoxy-phenyl)-2-oxidanyl-propyl]-cyclopropyl-azanium

Systemtic Name: [(2S)-2-(4-butoxy-3-methoxy-phenyl)-2-oxidanyl-propyl]-cyclopropyl-azanium Openeye Name: [(2S)-2-(4-butoxy-3-methoxy-phenyl)-2-hydroxy-propyl]-cyclopropyl-ammonium CAS Name: [(2S)-2-(4-butoxy-3-methoxyphenyl)-2-hydroxypropyl]-cyclopropylammonium IUPAC Name: [(2S)-2-(4-butoxy-3-methoxyphenyl)-2-hydroxypropyl]-cyclopropylazanium Traditional Name: [(2S)-2-(4-butoxy-3-methoxy-phenyl)-2-hydroxy-propyl]-cyclopropyl-ammonium Formula: C17H28NO3+ MolecularWeight: 294.40912

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(C)(C[NH2+]C2CC2)O)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)[C@@](C)(C[NH2+]C2CC2)O)OC

InChI

InChI=1S/C17H27NO3/c1-4-5-10-21-15-9-6-13(11-16(15)20-3)17(2,19)12-18-14-7-8-14/h6,9,11,14,18-19H,4-5,7-8,10,12H2,1-3H3/p+1/t17-/m1/s1