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

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

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC(C(C1)C2=C(C=CC(=C2)Cl)O)C3=CC(=C(C=C3)O)O

Isomeric SMILES

CN1CC(C(C1)C2=C(C=CC(=C2)Cl)O)C3=CC(=C(C=C3)O)O

InChI

InChI=1S/C17H18ClNO3/c1-19-8-13(10-2-4-16(21)17(22)6-10)14(9-19)12-7-11(18)3-5-15(12)20/h2-7,13-14,20-22H,8-9H2,1H3