4-(2-azanyl-1-oxidanyl-ethyl)-3-methyl-benzene-1,2-diol; phenoxybenzene

Systemtic Name: 4-(2-azanyl-1-oxidanyl-ethyl)-3-methyl-benzene-1,2-diol; phenoxybenzene Openeye Name: 4-(2-amino-1-hydroxy-ethyl)-3-methyl-benzene-1,2-diol; phenoxybenzene CAS Name: 4-(2-amino-1-hydroxyethyl)-3-methylbenzene-1,2-diol; phenoxybenzene IUPAC Name: 4-(2-amino-1-hydroxyethyl)-3-methylbenzene-1,2-diol; phenoxybenzene Traditional Name: 4-(2-amino-1-hydroxy-ethyl)-3-methyl-pyrocatechol; phenoxybenzene Formula: C21H23NO4 MolecularWeight: 353.41162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1O)O)C(CN)O.C1=CC=C(C=C1)OC2=CC=CC=C2

Isomeric SMILES

CC1=C(C=CC(=C1O)O)C(CN)O.C1=CC=C(C=C1)OC2=CC=CC=C2

InChI

InChI=1S/C12H10O.C9H13NO3/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;1-5-6(8(12)4-10)2-3-7(11)9(5)13/h1-10H;2-3,8,11-13H,4,10H2,1H3