methyl 2-[[butyl(methoxy)phosphoryl]-(phenylmethoxycarbonylamino)methyl]-3-methyl-hexanoate

Systemtic Name: methyl 2-[[butyl(methoxy)phosphoryl]-(phenylmethoxycarbonylamino)methyl]-3-methyl-hexanoate Openeye Name: methyl 2-[benzyloxycarbonylamino-[butyl(methoxy)phosphoryl]methyl]-3-methyl-hexanoate CAS Name: 2-[[butyl(methoxy)phosphoryl]-(phenylmethoxycarbonylamino)methyl]-3-methylhexanoic acid methyl ester IUPAC Name: methyl 2-[[butyl(methoxy)phosphoryl]-(phenylmethoxycarbonylamino)methyl]-3-methylhexanoate Traditional Name: 2-[benzyloxycarbonylamino-[butyl(methoxy)phosphoryl]methyl]-3-methyl-hexanoic acid methyl ester Formula: C22H36NO6P MolecularWeight: 441.498101

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Descriptors Computed from Structure

Canonical SMILES:

CCCCP(=O)(C(C(C(C)CCC)C(=O)OC)NC(=O)OCC1=CC=CC=C1)OC

Isomeric SMILES

CCCCP(=O)(C(C(C(C)CCC)C(=O)OC)NC(=O)OCC1=CC=CC=C1)OC

InChI

InChI=1S/C22H36NO6P/c1-6-8-15-30(26,28-5)20(19(21(24)27-4)17(3)12-7-2)23-22(25)29-16-18-13-10-9-11-14-18/h9-11,13-14,17,19-20H,6-8,12,15-16H2,1-5H3,(H,23,25)