[(2R)-3-[(3,4-dimethoxyphenyl)methoxy]-2-oxidanyl-propyl]-(3-methylbutyl)azanium

Systemtic Name: [(2R)-3-[(3,4-dimethoxyphenyl)methoxy]-2-oxidanyl-propyl]-(3-methylbutyl)azanium Openeye Name: [(2R)-3-[(3,4-dimethoxyphenyl)methoxy]-2-hydroxy-propyl]-isopentyl-ammonium CAS Name: [(2R)-3-[(3,4-dimethoxyphenyl)methoxy]-2-hydroxypropyl]-(3-methylbutyl)ammonium IUPAC Name: [(2R)-3-[(3,4-dimethoxyphenyl)methoxy]-2-hydroxypropyl]-(3-methylbutyl)azanium Traditional Name: [(2R)-2-hydroxy-3-veratryloxy-propyl]-isoamyl-ammonium Formula: C17H30NO4+ MolecularWeight: 312.4244

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC[NH2+]CC(COCC1=CC(=C(C=C1)OC)OC)O

Isomeric SMILES

CC(C)CC[NH2+]C[C@H](COCC1=CC(=C(C=C1)OC)OC)O

InChI

InChI=1S/C17H29NO4/c1-13(2)7-8-18-10-15(19)12-22-11-14-5-6-16(20-3)17(9-14)21-4/h5-6,9,13,15,18-19H,7-8,10-12H2,1-4H3/p+1/t15-/m1/s1