3,5-bis(chloranyl)-4-(4-methoxy-3-pyrrolidin-1-ylsulfonyl-phenoxy)benzenecarbonitrile

Systemtic Name: 3,5-bis(chloranyl)-4-(4-methoxy-3-pyrrolidin-1-ylsulfonyl-phenoxy)benzenecarbonitrile Openeye Name: 3,5-dichloro-4-(4-methoxy-3-pyrrolidin-1-ylsulfonyl-phenoxy)benzonitrile CAS Name: 3,5-dichloro-4-[4-methoxy-3-(1-pyrrolidinylsulfonyl)phenoxy]benzonitrile IUPAC Name: 3,5-dichloro-4-(4-methoxy-3-pyrrolidin-1-ylsulfonylphenoxy)benzonitrile Traditional Name: 3,5-dichloro-4-(4-methoxy-3-pyrrolidinosulfonyl-phenoxy)benzonitrile Formula: C18H16Cl2N2O4S MolecularWeight: 427.30164

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)OC2=C(C=C(C=C2Cl)C#N)Cl)S(=O)(=O)N3CCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)OC2=C(C=C(C=C2Cl)C#N)Cl)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C18H16Cl2N2O4S/c1-25-16-5-4-13(10-17(16)27(23,24)22-6-2-3-7-22)26-18-14(19)8-12(11-21)9-15(18)20/h4-5,8-10H,2-3,6-7H2,1H3