benzotriazol-1-yl 5-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate

Systemtic Name: benzotriazol-1-yl 5-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate Openeye Name: benzotriazol-1-yl 2-(tert-butoxycarbonylamino)-5-(1,3-dioxoisoindolin-2-yl)pentanoate CAS Name: 5-(1,3-dioxo-2-isoindolyl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]pentanoic acid 1-benzotriazolyl ester IUPAC Name: benzotriazol-1-yl 5-(1,3-dioxoisoindol-2-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate Traditional Name: 2-(tert-butoxycarbonylamino)-5-phthalimido-valeric acid benzotriazol-1-yl ester Formula: C24H25N5O6 MolecularWeight: 479.4852

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCCN1C(=O)C2=CC=CC=C2C1=O)C(=O)ON3C4=CC=CC=C4N=N3

Isomeric SMILES

CC(C)(C)OC(=O)NC(CCCN1C(=O)C2=CC=CC=C2C1=O)C(=O)ON3C4=CC=CC=C4N=N3

InChI

InChI=1S/C24H25N5O6/c1-24(2,3)34-23(33)25-18(22(32)35-29-19-13-7-6-11-17(19)26-27-29)12-8-14-28-20(30)15-9-4-5-10-16(15)21(28)31/h4-7,9-11,13,18H,8,12,14H2,1-3H3,(H,25,33)