(2S)-2-azanyl-1-(2-diphenoxyphosphorylpyrrolidin-1-yl)-3-methyl-butan-1-one

Systemtic Name: (2S)-2-azanyl-1-(2-diphenoxyphosphorylpyrrolidin-1-yl)-3-methyl-butan-1-one Openeye Name: (2S)-2-amino-1-(2-diphenoxyphosphorylpyrrolidin-1-yl)-3-methyl-butan-1-one CAS Name: (2S)-2-amino-1-(2-diphenoxyphosphoryl-1-pyrrolidinyl)-3-methyl-1-butanone IUPAC Name: (2S)-2-amino-1-(2-diphenoxyphosphorylpyrrolidin-1-yl)-3-methylbutan-1-one Traditional Name: (2S)-2-amino-1-(2-diphenoxyphosphorylpyrrolidino)-3-methyl-butan-1-one Formula: C21H27N2O4P MolecularWeight: 402.423841

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCCC1P(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3)N

Isomeric SMILES

CC(C)[C@@H](C(=O)N1CCCC1P(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3)N

InChI

InChI=1S/C21H27N2O4P/c1-16(2)20(22)21(24)23-15-9-14-19(23)28(25,26-17-10-5-3-6-11-17)27-18-12-7-4-8-13-18/h3-8,10-13,16,19-20H,9,14-15,22H2,1-2H3/t19?,20-/m0/s1