(1R)-1-(aminomethyl)-3-[(4-methoxyphenyl)methyl]-3,4-dihydro-1H-isochromene-5,6-diol

Systemtic Name: (1R)-1-(aminomethyl)-3-[(4-methoxyphenyl)methyl]-3,4-dihydro-1H-isochromene-5,6-diol Openeye Name: (1R)-1-(aminomethyl)-3-[(4-methoxyphenyl)methyl]isochromane-5,6-diol CAS Name: (1R)-1-(aminomethyl)-3-[(4-methoxyphenyl)methyl]-3,4-dihydro-1H-2-benzopyran-5,6-diol IUPAC Name: (1R)-1-(aminomethyl)-3-[(4-methoxyphenyl)methyl]-3,4-dihydro-1H-isochromene-5,6-diol Traditional Name: (1R)-1-(aminomethyl)-3-p-anisyl-isochroman-5,6-diol Formula: C18H21NO4 MolecularWeight: 315.36364

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC2CC3=C(C=CC(=C3O)O)C(O2)CN

Isomeric SMILES

COC1=CC=C(C=C1)CC2CC3=C(C=CC(=C3O)O)[C@@H](O2)CN

InChI

InChI=1S/C18H21NO4/c1-22-12-4-2-11(3-5-12)8-13-9-15-14(17(10-19)23-13)6-7-16(20)18(15)21/h2-7,13,17,20-21H,8-10,19H2,1H3/t13?,17-/m0/s1