4-[2-(hexylamino)ethyl]-3-[2-(3-hydroxyphenyl)ethyl]benzene-1,2-diol

Systemtic Name: 4-[2-(hexylamino)ethyl]-3-[2-(3-hydroxyphenyl)ethyl]benzene-1,2-diol Openeye Name: 4-[2-(hexylamino)ethyl]-3-[2-(3-hydroxyphenyl)ethyl]benzene-1,2-diol CAS Name: 4-[2-(hexylamino)ethyl]-3-[2-(3-hydroxyphenyl)ethyl]benzene-1,2-diol IUPAC Name: 4-[2-(hexylamino)ethyl]-3-[2-(3-hydroxyphenyl)ethyl]benzene-1,2-diol Traditional Name: 4-[2-(hexylamino)ethyl]-3-[2-(3-hydroxyphenyl)ethyl]pyrocatechol Formula: C22H31NO3 MolecularWeight: 357.48644

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNCCC1=C(C(=C(C=C1)O)O)CCC2=CC(=CC=C2)O

Isomeric SMILES

CCCCCCNCCC1=C(C(=C(C=C1)O)O)CCC2=CC(=CC=C2)O

InChI

InChI=1S/C22H31NO3/c1-2-3-4-5-14-23-15-13-18-10-12-21(25)22(26)20(18)11-9-17-7-6-8-19(24)16-17/h6-8,10,12,16,23-26H,2-5,9,11,13-15H2,1H3