3-[6-[2-[bis(4-methoxyphenyl)-phenyl-methoxy]ethyldisulfanyl]hexoxy-[di(propan-2-yl)amino]phosphanyl]oxypropanenitrile

Systemtic Name: 3-[6-[2-[bis(4-methoxyphenyl)-phenyl-methoxy]ethyldisulfanyl]hexoxy-[di(propan-2-yl)amino]phosphanyl]oxypropanenitrile Openeye Name: 3-[6-[2-[bis(4-methoxyphenyl)-phenyl-methoxy]ethyldisulfanyl]hexoxy-(diisopropylamino)phosphanyl]oxypropanenitrile CAS Name: 3-[6-[2-[bis(4-methoxyphenyl)-phenylmethoxy]ethyldisulfanyl]hexoxy-[di(propan-2-yl)amino]phosphino]oxypropanenitrile IUPAC Name: 3-[6-[2-[bis(4-methoxyphenyl)-phenylmethoxy]ethyldisulfanyl]hexoxy-[di(propan-2-yl)amino]phosphanyl]oxypropanenitrile Traditional Name: 3-[6-[2-[bis(4-methoxyphenyl)-phenyl-methoxy]ethyldisulfanyl]hexoxy-(diisopropylamino)phosphino]oxypropionitrile Formula: C38H53N2O5PS2 MolecularWeight: 712.941581

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C(C)C)P(OCCCCCCSSCCOC(C1=CC=CC=C1)(C2=CC=C(C=C2)OC)C3=CC=C(C=C3)OC)OCCC#N

Isomeric SMILES

CC(C)N(C(C)C)P(OCCCCCCSSCCOC(C1=CC=CC=C1)(C2=CC=C(C=C2)OC)C3=CC=C(C=C3)OC)OCCC#N

InChI

InChI=1S/C38H53N2O5PS2/c1-31(2)40(32(3)4)46(45-27-14-25-39)44-26-12-7-8-13-29-47-48-30-28-43-38(33-15-10-9-11-16-33,34-17-21-36(41-5)22-18-34)35-19-23-37(42-6)24-20-35/h9-11,15-24,31-32H,7-8,12-14,26-30H2,1-6H3