[(2-methylpropan-2-yl)oxycarbonylamino] 2-(3-oxidanylidene-1,2,4,5-tetrahydro-1,4-benzodiazepin-2-yl)ethanoate

Systemtic Name: [(2-methylpropan-2-yl)oxycarbonylamino] 2-(3-oxidanylidene-1,2,4,5-tetrahydro-1,4-benzodiazepin-2-yl)ethanoate Openeye Name: (tert-butoxycarbonylamino) 2-(3-oxo-1,2,4,5-tetrahydro-1,4-benzodiazepin-2-yl)acetate CAS Name: 2-(3-oxo-1,2,4,5-tetrahydro-1,4-benzodiazepin-2-yl)acetic acid [[(2-methylpropan-2-yl)oxy-oxomethyl]amino] ester IUPAC Name: [(2-methylpropan-2-yl)oxycarbonylamino] 2-(3-oxo-1,2,4,5-tetrahydro-1,4-benzodiazepin-2-yl)acetate Traditional Name: 2-(3-keto-1,2,4,5-tetrahydro-1,4-benzodiazepin-2-yl)acetic acid (tert-butoxycarbonylamino) ester Formula: C16H21N3O5 MolecularWeight: 335.35504

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NOC(=O)CC1C(=O)NCC2=CC=CC=C2N1

Isomeric SMILES

CC(C)(C)OC(=O)NOC(=O)CC1C(=O)NCC2=CC=CC=C2N1

InChI

InChI=1S/C16H21N3O5/c1-16(2,3)23-15(22)19-24-13(20)8-12-14(21)17-9-10-6-4-5-7-11(10)18-12/h4-7,12,18H,8-9H2,1-3H3,(H,17,21)(H,19,22)