bis(2-chloroethyl)amino-[[(E)-3-[2-[2-[bis(4-methoxyphenyl)-phenyl-methoxy]ethyl]-3,4,5-trimethoxy-phenyl]carbonyloxyprop-2-enyl]amino]phosphinic acid

Systemtic Name: bis(2-chloroethyl)amino-[[(E)-3-[2-[2-[bis(4-methoxyphenyl)-phenyl-methoxy]ethyl]-3,4,5-trimethoxy-phenyl]carbonyloxyprop-2-enyl]amino]phosphinic acid Openeye Name: bis(2-chloroethyl)amino-[[(E)-3-[2-[2-[bis(4-methoxyphenyl)-phenyl-methoxy]ethyl]-3,4,5-trimethoxy-benzoyl]oxyallyl]amino]phosphinic acid CAS Name: bis(2-chloroethyl)amino-[[(E)-3-[[2-[2-[bis(4-methoxyphenyl)-phenylmethoxy]ethyl]-3,4,5-trimethoxyphenyl]-oxomethoxy]prop-2-enyl]amino]phosphinic acid IUPAC Name: bis(2-chloroethyl)amino-[[(E)-3-[2-[2-[bis(4-methoxyphenyl)-phenylmethoxy]ethyl]-3,4,5-trimethoxybenzoyl]oxyprop-2-enyl]amino]phosphinic acid Traditional Name: bis(2-chloroethyl)amino-[[(E)-3-[2-[2-[bis(4-methoxyphenyl)-phenyl-methoxy]ethyl]-3,4,5-trimethoxy-benzoyl]oxyallyl]amino]phosphinic acid Formula: C40H47Cl2N2O10P MolecularWeight: 817.688341

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=C(C=C3)OC)OCCC4=C(C(=C(C=C4C(=O)OC=CCNP(=O)(N(CCCl)CCCl)O)OC)OC)OC

Isomeric SMILES

COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=C(C=C3)OC)OCCC4=C(C(=C(C=C4C(=O)O/C=C/CNP(=O)(N(CCCl)CCCl)O)OC)OC)OC

InChI

InChI=1S/C40H47Cl2N2O10P/c1-48-32-16-12-30(13-17-32)40(29-10-7-6-8-11-29,31-14-18-33(49-2)19-15-31)54-27-20-34-35(28-36(50-3)38(52-5)37(34)51-4)39(45)53-26-9-23-43-55(46,47)44(24-21-41)25-22-42/h6-19,26,28H,20-25,27H2,1-5H3,(H2,43,46,47)/b26-9+