2-chloroethyl N-[[(2S)-2-acetamido-3-phenyl-propanoyl]amino]carbamate

Systemtic Name: 2-chloroethyl N-[[(2S)-2-acetamido-3-phenyl-propanoyl]amino]carbamate Openeye Name: 2-chloroethyl N-[[(2S)-2-acetamido-3-phenyl-propanoyl]amino]carbamate CAS Name: N-[[(2S)-2-acetamido-1-oxo-3-phenylpropyl]amino]carbamic acid 2-chloroethyl ester IUPAC Name: 2-chloroethyl N-[[(2S)-2-acetamido-3-phenylpropanoyl]amino]carbamate Traditional Name: N-[[(2S)-2-acetamido-3-phenyl-propanoyl]amino]carbamic acid 2-chloroethyl ester Formula: C14H18ClN3O4 MolecularWeight: 327.76342

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=CC=CC=C1)C(=O)NNC(=O)OCCCl

Isomeric SMILES

CC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NNC(=O)OCCCl

InChI

InChI=1S/C14H18ClN3O4/c1-10(19)16-12(9-11-5-3-2-4-6-11)13(20)17-18-14(21)22-8-7-15/h2-6,12H,7-9H2,1H3,(H,16,19)(H,17,20)(H,18,21)/t12-/m0/s1