methyl 2-[[(2S)-1-azanyl-1-oxidanylidene-propan-2-yl]carbamoyl]-2-(phenylmethyl)azetidine-1-carboxylate

Systemtic Name: methyl 2-[[(2S)-1-azanyl-1-oxidanylidene-propan-2-yl]carbamoyl]-2-(phenylmethyl)azetidine-1-carboxylate Openeye Name: methyl 2-[[(1S)-2-amino-1-methyl-2-oxo-ethyl]carbamoyl]-2-benzyl-azetidine-1-carboxylate CAS Name: 2-[[[(2S)-1-amino-1-oxopropan-2-yl]amino]-oxomethyl]-2-(phenylmethyl)-1-azetidinecarboxylic acid methyl ester IUPAC Name: methyl 2-[[(2S)-1-amino-1-oxopropan-2-yl]carbamoyl]-2-benzylazetidine-1-carboxylate Traditional Name: 2-[[(1S)-2-amino-2-keto-1-methyl-ethyl]carbamoyl]-2-benzyl-azetidine-1-carboxylic acid methyl ester Formula: C16H21N3O4 MolecularWeight: 319.35564

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)NC(=O)C1(CCN1C(=O)OC)CC2=CC=CC=C2

Isomeric SMILES

C[C@@H](C(=O)N)NC(=O)C1(CCN1C(=O)OC)CC2=CC=CC=C2

InChI

InChI=1S/C16H21N3O4/c1-11(13(17)20)18-14(21)16(8-9-19(16)15(22)23-2)10-12-6-4-3-5-7-12/h3-7,11H,8-10H2,1-2H3,(H2,17,20)(H,18,21)/t11-,16?/m0/s1