(phenylmethyl) N-[(4S)-4-acetamido-5-oxidanylidene-5-[(phenylmethyl)amino]pentyl]carbamate

Systemtic Name: (phenylmethyl) N-[(4S)-4-acetamido-5-oxidanylidene-5-[(phenylmethyl)amino]pentyl]carbamate Openeye Name: benzyl N-[(4S)-4-acetamido-5-(benzylamino)-5-oxo-pentyl]carbamate CAS Name: N-[(4S)-4-acetamido-5-oxo-5-[(phenylmethyl)amino]pentyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(4S)-4-acetamido-5-(benzylamino)-5-oxopentyl]carbamate Traditional Name: N-[(4S)-4-acetamido-5-(benzylamino)-5-keto-pentyl]carbamic acid benzyl ester Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CCCNC(=O)OCC1=CC=CC=C1)C(=O)NCC2=CC=CC=C2

Isomeric SMILES

CC(=O)N[C@@H](CCCNC(=O)OCC1=CC=CC=C1)C(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C22H27N3O4/c1-17(26)25-20(21(27)24-15-18-9-4-2-5-10-18)13-8-14-23-22(28)29-16-19-11-6-3-7-12-19/h2-7,9-12,20H,8,13-16H2,1H3,(H,23,28)(H,24,27)(H,25,26)/t20-/m0/s1