4-[2-azanyl-6-(1-hexoxypropyl)-3-(2-hydroxyethyl)phenyl]-3-methyl-benzene-1,2-diol

Systemtic Name: 4-[2-azanyl-6-(1-hexoxypropyl)-3-(2-hydroxyethyl)phenyl]-3-methyl-benzene-1,2-diol Openeye Name: 4-[2-amino-6-(1-hexoxypropyl)-3-(2-hydroxyethyl)phenyl]-3-methyl-benzene-1,2-diol CAS Name: 4-[2-amino-6-(1-hexoxypropyl)-3-(2-hydroxyethyl)phenyl]-3-methylbenzene-1,2-diol IUPAC Name: 4-[2-amino-6-(1-hexoxypropyl)-3-(2-hydroxyethyl)phenyl]-3-methylbenzene-1,2-diol Traditional Name: 4-[2-amino-6-(1-hexoxypropyl)-3-(2-hydroxyethyl)phenyl]-3-methyl-pyrocatechol Formula: C24H35NO4 MolecularWeight: 401.539

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(CC)C1=C(C(=C(C=C1)CCO)N)C2=C(C(=C(C=C2)O)O)C

Isomeric SMILES

CCCCCCOC(CC)C1=C(C(=C(C=C1)CCO)N)C2=C(C(=C(C=C2)O)O)C

InChI

InChI=1S/C24H35NO4/c1-4-6-7-8-15-29-21(5-2)19-10-9-17(13-14-26)23(25)22(19)18-11-12-20(27)24(28)16(18)3/h9-12,21,26-28H,4-8,13-15,25H2,1-3H3