4-(2-azanylethyl)-6-chloranyl-3-[2-(3-hydroxyphenyl)ethyl]benzene-1,2-diol

Systemtic Name: 4-(2-azanylethyl)-6-chloranyl-3-[2-(3-hydroxyphenyl)ethyl]benzene-1,2-diol Openeye Name: 4-(2-aminoethyl)-6-chloro-3-[2-(3-hydroxyphenyl)ethyl]benzene-1,2-diol CAS Name: 4-(2-aminoethyl)-6-chloro-3-[2-(3-hydroxyphenyl)ethyl]benzene-1,2-diol IUPAC Name: 4-(2-aminoethyl)-6-chloro-3-[2-(3-hydroxyphenyl)ethyl]benzene-1,2-diol Traditional Name: 4-(2-aminoethyl)-6-chloro-3-[2-(3-hydroxyphenyl)ethyl]pyrocatechol Formula: C16H18ClNO3 MolecularWeight: 307.77202

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)O)CCC2=C(C(=C(C=C2CCN)Cl)O)O

Isomeric SMILES

C1=CC(=CC(=C1)O)CCC2=C(C(=C(C=C2CCN)Cl)O)O

InChI

InChI=1S/C16H18ClNO3/c17-14-9-11(6-7-18)13(15(20)16(14)21)5-4-10-2-1-3-12(19)8-10/h1-3,8-9,19-21H,4-7,18H2