(phenylmethyl) 4-[methoxy-[[4-(3-oxidanylidene-3-prop-2-enoxy-propyl)phenyl]amino]phosphanyl]oxybenzoate

Systemtic Name: (phenylmethyl) 4-[methoxy-[[4-(3-oxidanylidene-3-prop-2-enoxy-propyl)phenyl]amino]phosphanyl]oxybenzoate Openeye Name: benzyl 4-[[4-(3-allyloxy-3-oxo-propyl)anilino]-methoxy-phosphanyl]oxybenzoate CAS Name: 4-[methoxy-[4-(3-oxo-3-prop-2-enoxypropyl)anilino]phosphino]oxybenzoic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[methoxy-[4-(3-oxo-3-prop-2-enoxypropyl)anilino]phosphanyl]oxybenzoate Traditional Name: 4-[[4-(3-allyloxy-3-keto-propyl)anilino]-methoxy-phosphino]oxybenzoic acid benzyl ester Formula: C27H28NO6P MolecularWeight: 493.488081

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Descriptors Computed from Structure

Canonical SMILES:

COP(NC1=CC=C(C=C1)CCC(=O)OCC=C)OC2=CC=C(C=C2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

COP(NC1=CC=C(C=C1)CCC(=O)OCC=C)OC2=CC=C(C=C2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C27H28NO6P/c1-3-19-32-26(29)18-11-21-9-14-24(15-10-21)28-35(31-2)34-25-16-12-23(13-17-25)27(30)33-20-22-7-5-4-6-8-22/h3-10,12-17,28H,1,11,18-20H2,2H3