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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H31NO3/c1-3-4-5-6-14-23-16(2)19-12-13-21(25)22(26)20(19)11-10-17-8-7-9-18(24)15-17/h7-9,12-13,15-16,23-26H,3-6,10-11,14H2,1-2H3