3-ethyl-4-[[(E)-hex-3-enyl]amino]-6-(phenethylamino)benzene-1,2-diol

Systemtic Name: 3-ethyl-4-[[(E)-hex-3-enyl]amino]-6-(phenethylamino)benzene-1,2-diol Openeye Name: 3-ethyl-4-[[(E)-hex-3-enyl]amino]-6-(phenethylamino)benzene-1,2-diol CAS Name: 3-ethyl-4-[[(E)-hex-3-enyl]amino]-6-(phenethylamino)benzene-1,2-diol IUPAC Name: 3-ethyl-4-[[(E)-hex-3-enyl]amino]-6-(phenethylamino)benzene-1,2-diol Traditional Name: 3-ethyl-4-[[(E)-hex-3-enyl]amino]-6-(phenethylamino)pyrocatechol Formula: C22H30N2O2 MolecularWeight: 354.4858

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Descriptors Computed from Structure

Canonical SMILES:

CCC=CCCNC1=CC(=C(C(=C1CC)O)O)NCCC2=CC=CC=C2

Isomeric SMILES

CC/C=C/CCNC1=CC(=C(C(=C1CC)O)O)NCCC2=CC=CC=C2

InChI

InChI=1S/C22H30N2O2/c1-3-5-6-10-14-23-19-16-20(22(26)21(25)18(19)4-2)24-15-13-17-11-8-7-9-12-17/h5-9,11-12,16,23-26H,3-4,10,13-15H2,1-2H3/b6-5+