3-[[di(propan-2-yl)amino]-[2-(6-methoxy-7-methyl-3-oxidanylidene-4-phenylmethoxy-1H-2-benzofuran-5-yl)ethoxy]phosphanyl]oxypropanenitrile

Systemtic Name: 3-[[di(propan-2-yl)amino]-[2-(6-methoxy-7-methyl-3-oxidanylidene-4-phenylmethoxy-1H-2-benzofuran-5-yl)ethoxy]phosphanyl]oxypropanenitrile Openeye Name: 3-[2-(4-benzyloxy-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)ethoxy-(diisopropylamino)phosphanyl]oxypropanenitrile CAS Name: 3-[[di(propan-2-yl)amino]-[2-(6-methoxy-7-methyl-3-oxo-4-phenylmethoxy-1H-isobenzofuran-5-yl)ethoxy]phosphino]oxypropanenitrile IUPAC Name: 3-[[di(propan-2-yl)amino]-[2-(6-methoxy-7-methyl-3-oxo-4-phenylmethoxy-1H-2-benzofuran-5-yl)ethoxy]phosphanyl]oxypropanenitrile Traditional Name: 3-[2-(4-benzoxy-3-keto-6-methoxy-7-methyl-phthalan-5-yl)ethoxy-(diisopropylamino)phosphino]oxypropionitrile Formula: C28H37N2O6P MolecularWeight: 528.576941

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C2=C1COC2=O)OCC3=CC=CC=C3)CCOP(N(C(C)C)C(C)C)OCCC#N)OC

Isomeric SMILES

CC1=C(C(=C(C2=C1COC2=O)OCC3=CC=CC=C3)CCOP(N(C(C)C)C(C)C)OCCC#N)OC

InChI

InChI=1S/C28H37N2O6P/c1-19(2)30(20(3)4)37(35-15-10-14-29)36-16-13-23-26(32-6)21(5)24-18-34-28(31)25(24)27(23)33-17-22-11-8-7-9-12-22/h7-9,11-12,19-20H,10,13,15-18H2,1-6H3