(1R,3S)-3-phenyl-1-[(prop-2-enylamino)methyl]-3,4-dihydro-1H-isochromene-5,6-diol

Systemtic Name: (1R,3S)-3-phenyl-1-[(prop-2-enylamino)methyl]-3,4-dihydro-1H-isochromene-5,6-diol Openeye Name: (1R,3S)-1-[(allylamino)methyl]-3-phenyl-isochromane-5,6-diol CAS Name: (1R,3S)-3-phenyl-1-[(prop-2-enylamino)methyl]-3,4-dihydro-1H-2-benzopyran-5,6-diol IUPAC Name: (1R,3S)-3-phenyl-1-[(prop-2-enylamino)methyl]-3,4-dihydro-1H-isochromene-5,6-diol Traditional Name: (1R,3S)-1-[(allylamino)methyl]-3-phenyl-isochroman-5,6-diol Formula: C19H21NO3 MolecularWeight: 311.37494

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNCC1C2=C(CC(O1)C3=CC=CC=C3)C(=C(C=C2)O)O

Isomeric SMILES

C=CCNC[C@H]1C2=C(C[C@H](O1)C3=CC=CC=C3)C(=C(C=C2)O)O

InChI

InChI=1S/C19H21NO3/c1-2-10-20-12-18-14-8-9-16(21)19(22)15(14)11-17(23-18)13-6-4-3-5-7-13/h2-9,17-18,20-22H,1,10-12H2/t17-,18-/m0/s1