2-(3,4-dimethoxyphenyl)sulfanyl-N-(3-nitrophenyl)propanamide

Systemtic Name: 2-(3,4-dimethoxyphenyl)sulfanyl-N-(3-nitrophenyl)propanamide Openeye Name: 2-(3,4-dimethoxyphenyl)sulfanyl-N-(3-nitrophenyl)propanamide CAS Name: 2-[(3,4-dimethoxyphenyl)thio]-N-(3-nitrophenyl)propanamide IUPAC Name: 2-(3,4-dimethoxyphenyl)sulfanyl-N-(3-nitrophenyl)propanamide Traditional Name: 2-[(3,4-dimethoxyphenyl)thio]-N-(3-nitrophenyl)propionamide Formula: C17H18N2O5S MolecularWeight: 362.40022

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC=C1)[N+](=O)[O-])SC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC(C(=O)NC1=CC(=CC=C1)[N+](=O)[O-])SC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C17H18N2O5S/c1-11(25-14-7-8-15(23-2)16(10-14)24-3)17(20)18-12-5-4-6-13(9-12)19(21)22/h4-11H,1-3H3,(H,18,20)