2-(4-chlorophenyl)sulfanyl-5-nitro-N-prop-2-enyl-benzamide

Systemtic Name: 2-(4-chlorophenyl)sulfanyl-5-nitro-N-prop-2-enyl-benzamide Openeye Name: N-allyl-2-(4-chlorophenyl)sulfanyl-5-nitro-benzamide CAS Name: 2-[(4-chlorophenyl)thio]-5-nitro-N-prop-2-enylbenzamide IUPAC Name: 2-(4-chlorophenyl)sulfanyl-5-nitro-N-prop-2-enylbenzamide Traditional Name: N-allyl-2-[(4-chlorophenyl)thio]-5-nitro-benzamide Formula: C16H13ClN2O3S MolecularWeight: 348.80402

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])SC2=CC=C(C=C2)Cl

Isomeric SMILES

C=CCNC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])SC2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H13ClN2O3S/c1-2-9-18-16(20)14-10-12(19(21)22)5-8-15(14)23-13-6-3-11(17)4-7-13/h2-8,10H,1,9H2,(H,18,20)