methyl N-[(1R,2S)-3-chloranyl-1-cyano-2-phenylmethoxy-propyl]-N-(phenylmethyl)carbamate

Systemtic Name: methyl N-[(1R,2S)-3-chloranyl-1-cyano-2-phenylmethoxy-propyl]-N-(phenylmethyl)carbamate Openeye Name: methyl N-benzyl-N-[(1R,2S)-2-benzyloxy-3-chloro-1-cyano-propyl]carbamate CAS Name: N-[(1R,2S)-3-chloro-1-cyano-2-phenylmethoxypropyl]-N-(phenylmethyl)carbamic acid methyl ester IUPAC Name: methyl N-benzyl-N-[(1R,2S)-3-chloro-1-cyano-2-phenylmethoxypropyl]carbamate Traditional Name: N-[(1R,2S)-2-benzoxy-3-chloro-1-cyano-propyl]-N-benzyl-carbamic acid methyl ester Formula: C20H21ClN2O3 MolecularWeight: 372.84534

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N(CC1=CC=CC=C1)C(C#N)C(CCl)OCC2=CC=CC=C2

Isomeric SMILES

COC(=O)N(CC1=CC=CC=C1)[C@H](C#N)[C@@H](CCl)OCC2=CC=CC=C2

InChI

InChI=1S/C20H21ClN2O3/c1-25-20(24)23(14-16-8-4-2-5-9-16)18(13-22)19(12-21)26-15-17-10-6-3-7-11-17/h2-11,18-19H,12,14-15H2,1H3/t18-,19-/m1/s1