[(2R)-3-[(3,4-dimethoxyphenyl)methoxy]-2-oxidanyl-propyl]-(phenylmethyl)-propan-2-yl-azanium

Systemtic Name: [(2R)-3-[(3,4-dimethoxyphenyl)methoxy]-2-oxidanyl-propyl]-(phenylmethyl)-propan-2-yl-azanium Openeye Name: benzyl-[(2R)-3-[(3,4-dimethoxyphenyl)methoxy]-2-hydroxy-propyl]-isopropyl-ammonium CAS Name: [(2R)-3-[(3,4-dimethoxyphenyl)methoxy]-2-hydroxypropyl]-(phenylmethyl)-propan-2-ylammonium IUPAC Name: benzyl-[(2R)-3-[(3,4-dimethoxyphenyl)methoxy]-2-hydroxypropyl]-propan-2-ylazanium Traditional Name: benzyl-[(2R)-2-hydroxy-3-veratryloxy-propyl]-isopropyl-ammonium Formula: C22H32NO4+ MolecularWeight: 374.49378

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](CC1=CC=CC=C1)CC(COCC2=CC(=C(C=C2)OC)OC)O

Isomeric SMILES

CC(C)[NH+](CC1=CC=CC=C1)C[C@H](COCC2=CC(=C(C=C2)OC)OC)O

InChI

InChI=1S/C22H31NO4/c1-17(2)23(13-18-8-6-5-7-9-18)14-20(24)16-27-15-19-10-11-21(25-3)22(12-19)26-4/h5-12,17,20,24H,13-16H2,1-4H3/p+1/t20-/m1/s1