4-[(2R)-1-[5-chloranyl-2,4-bis(oxidanyl)phenyl]carbonylpyrrolidin-2-yl]-3-methyl-benzenecarbonitrile

Systemtic Name: 4-[(2R)-1-[5-chloranyl-2,4-bis(oxidanyl)phenyl]carbonylpyrrolidin-2-yl]-3-methyl-benzenecarbonitrile Openeye Name: 4-[(2R)-1-(5-chloro-2,4-dihydroxy-benzoyl)pyrrolidin-2-yl]-3-methyl-benzonitrile CAS Name: 4-[(2R)-1-[(5-chloro-2,4-dihydroxyphenyl)-oxomethyl]-2-pyrrolidinyl]-3-methylbenzonitrile IUPAC Name: 4-[(2R)-1-(5-chloro-2,4-dihydroxybenzoyl)pyrrolidin-2-yl]-3-methylbenzonitrile Traditional Name: 4-[(2R)-1-(5-chloro-2,4-dihydroxy-benzoyl)pyrrolidin-2-yl]-3-methyl-benzonitrile Formula: C19H17ClN2O3 MolecularWeight: 356.80288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C#N)C2CCCN2C(=O)C3=CC(=C(C=C3O)O)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)C#N)[C@H]2CCCN2C(=O)C3=CC(=C(C=C3O)O)Cl

InChI

InChI=1S/C19H17ClN2O3/c1-11-7-12(10-21)4-5-13(11)16-3-2-6-22(16)19(25)14-8-15(20)18(24)9-17(14)23/h4-5,7-9,16,23-24H,2-3,6H2,1H3/t16-/m1/s1