(1S)-2-(1,3-benzodioxol-5-ylamino)-1-(4-methylphenyl)ethanol

Systemtic Name: (1S)-2-(1,3-benzodioxol-5-ylamino)-1-(4-methylphenyl)ethanol Openeye Name: (1S)-2-(1,3-benzodioxol-5-ylamino)-1-(p-tolyl)ethanol CAS Name: (1S)-2-(1,3-benzodioxol-5-ylamino)-1-(4-methylphenyl)ethanol IUPAC Name: (1S)-2-(1,3-benzodioxol-5-ylamino)-1-(4-methylphenyl)ethanol Traditional Name: (1S)-2-(1,3-benzodioxol-5-ylamino)-1-(p-tolyl)ethanol Formula: C16H17NO3 MolecularWeight: 271.31108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CNC2=CC3=C(C=C2)OCO3)O

Isomeric SMILES

CC1=CC=C(C=C1)[C@@H](CNC2=CC3=C(C=C2)OCO3)O

InChI

InChI=1S/C16H17NO3/c1-11-2-4-12(5-3-11)14(18)9-17-13-6-7-15-16(8-13)20-10-19-15/h2-8,14,17-18H,9-10H2,1H3/t14-/m1/s1