benzotriazol-1-yl (2S)-2-(butoxycarbonylamino)-4-methyl-pentanoate

Systemtic Name: benzotriazol-1-yl (2S)-2-(butoxycarbonylamino)-4-methyl-pentanoate Openeye Name: benzotriazol-1-yl (2S)-2-(butoxycarbonylamino)-4-methyl-pentanoate CAS Name: (2S)-2-[[butoxy(oxo)methyl]amino]-4-methylpentanoic acid 1-benzotriazolyl ester IUPAC Name: benzotriazol-1-yl (2S)-2-(butoxycarbonylamino)-4-methylpentanoate Traditional Name: (2S)-2-(butoxycarbonylamino)-4-methyl-valeric acid benzotriazol-1-yl ester Formula: C17H24N4O4 MolecularWeight: 348.39686

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)NC(CC(C)C)C(=O)ON1C2=CC=CC=C2N=N1

Isomeric SMILES

CCCCOC(=O)N[C@@H](CC(C)C)C(=O)ON1C2=CC=CC=C2N=N1

InChI

InChI=1S/C17H24N4O4/c1-4-5-10-24-17(23)18-14(11-12(2)3)16(22)25-21-15-9-7-6-8-13(15)19-20-21/h6-9,12,14H,4-5,10-11H2,1-3H3,(H,18,23)/t14-/m0/s1