N-(cyclopropylmethyl)-2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]ethanamide

Systemtic Name: N-(cyclopropylmethyl)-2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]ethanamide Openeye Name: N-(cyclopropylmethyl)-2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]acetamide CAS Name: N-(cyclopropylmethyl)-2-[(4-methoxy-3-nitrophenyl)methylthio]acetamide IUPAC Name: N-(cyclopropylmethyl)-2-[(4-methoxy-3-nitrophenyl)methylsulfanyl]acetamide Traditional Name: N-(cyclopropylmethyl)-2-[(4-methoxy-3-nitro-benzyl)thio]acetamide Formula: C14H18N2O4S MolecularWeight: 310.36872

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CSCC(=O)NCC2CC2)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)CSCC(=O)NCC2CC2)[N+](=O)[O-]

InChI

InChI=1S/C14H18N2O4S/c1-20-13-5-4-11(6-12(13)16(18)19)8-21-9-14(17)15-7-10-2-3-10/h4-6,10H,2-3,7-9H2,1H3,(H,15,17)