1-[2-(3-methylphenyl)cyclohex-2-en-1-yl]sulfanyl-2,4-dinitro-benzene

Systemtic Name: 1-[2-(3-methylphenyl)cyclohex-2-en-1-yl]sulfanyl-2,4-dinitro-benzene Openeye Name: 1-[2-(m-tolyl)cyclohex-2-en-1-yl]sulfanyl-2,4-dinitro-benzene CAS Name: 1-[[2-(3-methylphenyl)-1-cyclohex-2-enyl]thio]-2,4-dinitrobenzene IUPAC Name: 1-[2-(3-methylphenyl)cyclohex-2-en-1-yl]sulfanyl-2,4-dinitrobenzene Traditional Name: 1-[[2-(m-tolyl)cyclohex-2-en-1-yl]thio]-2,4-dinitro-benzene Formula: C19H18N2O4S MolecularWeight: 370.42222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=CCCCC2SC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC(=C1)C2=CCCCC2SC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C19H18N2O4S/c1-13-5-4-6-14(11-13)16-7-2-3-8-18(16)26-19-10-9-15(20(22)23)12-17(19)21(24)25/h4-7,9-12,18H,2-3,8H2,1H3