(3-naphthalen-1-ylpropanoylamino) (2S)-4-azanyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanylidene-butanoate

Systemtic Name: (3-naphthalen-1-ylpropanoylamino) (2S)-4-azanyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanylidene-butanoate Openeye Name: [3-(1-naphthyl)propanoylamino] (2S)-4-amino-2-(tert-butoxycarbonylamino)-4-oxo-butanoate CAS Name: (2S)-4-amino-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-oxobutanoic acid [[3-(1-naphthalenyl)-1-oxopropyl]amino] ester IUPAC Name: (3-naphthalen-1-ylpropanoylamino) (2S)-4-amino-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxobutanoate Traditional Name: (2S)-4-amino-2-(tert-butoxycarbonylamino)-4-keto-butyric acid [3-(1-naphthyl)propanoylamino] ester Formula: C22H27N3O6 MolecularWeight: 429.46628

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC(=O)N)C(=O)ONC(=O)CCC1=CC=CC2=CC=CC=C21

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC(=O)N)C(=O)ONC(=O)CCC1=CC=CC2=CC=CC=C21

InChI

InChI=1S/C22H27N3O6/c1-22(2,3)30-21(29)24-17(13-18(23)26)20(28)31-25-19(27)12-11-15-9-6-8-14-7-4-5-10-16(14)15/h4-10,17H,11-13H2,1-3H3,(H2,23,26)(H,24,29)(H,25,27)/t17-/m0/s1