methyl (3S,4S,5R)-5-methyl-3-oxidanyl-4-(phenylmethoxycarbonylamino)heptanoate

Systemtic Name: methyl (3S,4S,5R)-5-methyl-3-oxidanyl-4-(phenylmethoxycarbonylamino)heptanoate Openeye Name: methyl (3S,4S,5R)-4-(benzyloxycarbonylamino)-3-hydroxy-5-methyl-heptanoate CAS Name: (3S,4S,5R)-3-hydroxy-5-methyl-4-(phenylmethoxycarbonylamino)heptanoic acid methyl ester IUPAC Name: methyl (3S,4S,5R)-3-hydroxy-5-methyl-4-(phenylmethoxycarbonylamino)heptanoate Traditional Name: (3S,4S,5R)-4-(benzyloxycarbonylamino)-3-hydroxy-5-methyl-enanthic acid methyl ester Formula: C17H25NO5 MolecularWeight: 323.3841

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC[C@@H](C)[C@@H]([C@H](CC(=O)OC)O)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C17H25NO5/c1-4-12(2)16(14(19)10-15(20)22-3)18-17(21)23-11-13-8-6-5-7-9-13/h5-9,12,14,16,19H,4,10-11H2,1-3H3,(H,18,21)/t12-,14+,16+/m1/s1