methyl (4S)-3-oxidanylidene-4-(phenylmethoxycarbonylamino)heptanoate

Systemtic Name: methyl (4S)-3-oxidanylidene-4-(phenylmethoxycarbonylamino)heptanoate Openeye Name: methyl (4S)-4-(benzyloxycarbonylamino)-3-oxo-heptanoate CAS Name: (4S)-3-oxo-4-(phenylmethoxycarbonylamino)heptanoic acid methyl ester IUPAC Name: methyl (4S)-3-oxo-4-(phenylmethoxycarbonylamino)heptanoate Traditional Name: (4S)-4-(benzyloxycarbonylamino)-3-keto-enanthic acid methyl ester Formula: C16H21NO5 MolecularWeight: 307.34164

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21NO5/c1-3-7-13(14(18)10-15(19)21-2)17-16(20)22-11-12-8-5-4-6-9-12/h4-6,8-9,13H,3,7,10-11H2,1-2H3,(H,17,20)/t13-/m0/s1