4-[4-[(5-chloranyl-2-oxidanyl-phenyl)methyl]pyrrolidin-3-yl]benzene-1,2-diol

Systemtic Name: 4-[4-[(5-chloranyl-2-oxidanyl-phenyl)methyl]pyrrolidin-3-yl]benzene-1,2-diol Openeye Name: 4-[4-[(5-chloro-2-hydroxy-phenyl)methyl]pyrrolidin-3-yl]benzene-1,2-diol CAS Name: 4-[4-[(5-chloro-2-hydroxyphenyl)methyl]-3-pyrrolidinyl]benzene-1,2-diol IUPAC Name: 4-[4-[(5-chloro-2-hydroxyphenyl)methyl]pyrrolidin-3-yl]benzene-1,2-diol Traditional Name: 4-[4-(5-chloro-2-hydroxy-benzyl)pyrrolidin-3-yl]pyrocatechol Formula: C17H18ClNO3 MolecularWeight: 319.78272

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(CN1)C2=CC(=C(C=C2)O)O)CC3=C(C=CC(=C3)Cl)O

Isomeric SMILES

C1C(C(CN1)C2=CC(=C(C=C2)O)O)CC3=C(C=CC(=C3)Cl)O

InChI

InChI=1S/C17H18ClNO3/c18-13-2-4-15(20)11(6-13)5-12-8-19-9-14(12)10-1-3-16(21)17(22)7-10/h1-4,6-7,12,14,19-22H,5,8-9H2