methyl (1S)-5-diethoxyphosphoryl-1-[[(1S)-2-oxidanyl-1-phenyl-ethyl]amino]-2,3-dihydroindene-1-carboxylate

Systemtic Name: methyl (1S)-5-diethoxyphosphoryl-1-[[(1S)-2-oxidanyl-1-phenyl-ethyl]amino]-2,3-dihydroindene-1-carboxylate Openeye Name: methyl (1S)-5-diethoxyphosphoryl-1-[[(1S)-2-hydroxy-1-phenyl-ethyl]amino]indane-1-carboxylate CAS Name: (1S)-5-diethoxyphosphoryl-1-[[(1S)-2-hydroxy-1-phenylethyl]amino]-2,3-dihydroindene-1-carboxylic acid methyl ester IUPAC Name: methyl (1S)-5-diethoxyphosphoryl-1-[[(1S)-2-hydroxy-1-phenylethyl]amino]-2,3-dihydroindene-1-carboxylate Traditional Name: (1S)-5-diethoxyphosphoryl-1-[[(1S)-2-hydroxy-1-phenyl-ethyl]amino]indane-1-carboxylic acid methyl ester Formula: C23H30NO6P MolecularWeight: 447.461161

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C1=CC2=C(C=C1)C(CC2)(C(=O)OC)NC(CO)C3=CC=CC=C3)OCC

Isomeric SMILES

CCOP(=O)(C1=CC2=C(C=C1)[C@@](CC2)(C(=O)OC)N[C@H](CO)C3=CC=CC=C3)OCC

InChI

InChI=1S/C23H30NO6P/c1-4-29-31(27,30-5-2)19-11-12-20-18(15-19)13-14-23(20,22(26)28-3)24-21(16-25)17-9-7-6-8-10-17/h6-12,15,21,24-25H,4-5,13-14,16H2,1-3H3/t21-,23+/m1/s1