(phenylmethyl) N-[4-[[(2S)-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-4-oxidanylidene-butyl]carbamate

Systemtic Name: (phenylmethyl) N-[4-[[(2S)-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-4-oxidanylidene-butyl]carbamate Openeye Name: benzyl N-[4-[[(1S)-2-amino-1-benzyl-2-oxo-ethyl]amino]-4-oxo-butyl]carbamate CAS Name: N-[4-[[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]amino]-4-oxobutyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[4-[[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]amino]-4-oxobutyl]carbamate Traditional Name: N-[4-[[(1S)-2-amino-1-benzyl-2-keto-ethyl]amino]-4-keto-butyl]carbamic acid benzyl ester Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)N)NC(=O)CCCNC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)N)NC(=O)CCCNC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C21H25N3O4/c22-20(26)18(14-16-8-3-1-4-9-16)24-19(25)12-7-13-23-21(27)28-15-17-10-5-2-6-11-17/h1-6,8-11,18H,7,12-15H2,(H2,22,26)(H,23,27)(H,24,25)/t18-/m0/s1