N-(2-methylcyclohexyl)-2-(4-nitrophenyl)sulfanyl-propanamide

Systemtic Name: N-(2-methylcyclohexyl)-2-(4-nitrophenyl)sulfanyl-propanamide Openeye Name: N-(2-methylcyclohexyl)-2-(4-nitrophenyl)sulfanyl-propanamide CAS Name: N-(2-methylcyclohexyl)-2-[(4-nitrophenyl)thio]propanamide IUPAC Name: N-(2-methylcyclohexyl)-2-(4-nitrophenyl)sulfanylpropanamide Traditional Name: N-(2-methylcyclohexyl)-2-[(4-nitrophenyl)thio]propionamide Formula: C16H22N2O3S MolecularWeight: 322.42248

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)C(C)SC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1CCCCC1NC(=O)C(C)SC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H22N2O3S/c1-11-5-3-4-6-15(11)17-16(19)12(2)22-14-9-7-13(8-10-14)18(20)21/h7-12,15H,3-6H2,1-2H3,(H,17,19)