1-[4-[ethoxy(2-methylpropylsulfanyl)phosphoryl]oxyphenyl]sulfanyl-2-nitro-benzene

Systemtic Name: 1-[4-[ethoxy(2-methylpropylsulfanyl)phosphoryl]oxyphenyl]sulfanyl-2-nitro-benzene Openeye Name: 1-[4-[ethoxy(isobutylsulfanyl)phosphoryl]oxyphenyl]sulfanyl-2-nitro-benzene CAS Name: 1-[[4-[ethoxy-(2-methylpropylthio)phosphoryl]oxyphenyl]thio]-2-nitrobenzene IUPAC Name: 1-[4-[ethoxy(2-methylpropylsulfanyl)phosphoryl]oxyphenyl]sulfanyl-2-nitrobenzene Traditional Name: 1-[[4-[ethoxy-(isobutylthio)phosphoryl]oxyphenyl]thio]-2-nitro-benzene Formula: C18H22NO5PS2 MolecularWeight: 427.474741

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(OC1=CC=C(C=C1)SC2=CC=CC=C2[N+](=O)[O-])SCC(C)C

Isomeric SMILES

CCOP(=O)(OC1=CC=C(C=C1)SC2=CC=CC=C2[N+](=O)[O-])SCC(C)C

InChI

InChI=1S/C18H22NO5PS2/c1-4-23-25(22,26-13-14(2)3)24-15-9-11-16(12-10-15)27-18-8-6-5-7-17(18)19(20)21/h5-12,14H,4,13H2,1-3H3