phosphorosomethyl 3-(4-methylphenyl)-2-[pentanoyl(phenylmethoxycarbonylaminomethyl)amino]propanoate

Systemtic Name: phosphorosomethyl 3-(4-methylphenyl)-2-[pentanoyl(phenylmethoxycarbonylaminomethyl)amino]propanoate Openeye Name: phosphorosomethyl 2-[benzyloxycarbonylaminomethyl(pentanoyl)amino]-3-(p-tolyl)propanoate CAS Name: 3-(4-methylphenyl)-2-[1-oxopentyl(phenylmethoxycarbonylaminomethyl)amino]propanoic acid phosphorosomethyl ester IUPAC Name: phosphorosomethyl 3-(4-methylphenyl)-2-[pentanoyl(phenylmethoxycarbonylaminomethyl)amino]propanoate Traditional Name: 2-[benzyloxycarbonylaminomethyl(valeryl)amino]-3-(p-tolyl)propionic acid phosphorosomethyl ester Formula: C25H31N2O6P MolecularWeight: 486.497201

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N(CNC(=O)OCC1=CC=CC=C1)C(CC2=CC=C(C=C2)C)C(=O)OCP=O

Isomeric SMILES

CCCCC(=O)N(CNC(=O)OCC1=CC=CC=C1)C(CC2=CC=C(C=C2)C)C(=O)OCP=O

InChI

InChI=1S/C25H31N2O6P/c1-3-4-10-23(28)27(17-26-25(30)32-16-21-8-6-5-7-9-21)22(24(29)33-18-34-31)15-20-13-11-19(2)12-14-20/h5-9,11-14,22H,3-4,10,15-18H2,1-2H3,(H,26,30)