2-[7-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanylidene-1,2,4,5-tetrahydro-1,4-benzodiazepin-2-yl]ethanoate

Systemtic Name: 2-[7-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanylidene-1,2,4,5-tetrahydro-1,4-benzodiazepin-2-yl]ethanoate Openeye Name: 2-[7-(tert-butoxycarbonylamino)-3-oxo-1,2,4,5-tetrahydro-1,4-benzodiazepin-2-yl]acetate CAS Name: 2-[7-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-oxo-1,2,4,5-tetrahydro-1,4-benzodiazepin-2-yl]acetate IUPAC Name: 2-[7-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxo-1,2,4,5-tetrahydro-1,4-benzodiazepin-2-yl]acetate Traditional Name: 2-[7-(tert-butoxycarbonylamino)-3-keto-1,2,4,5-tetrahydro-1,4-benzodiazepin-2-yl]acetate Formula: C16H20N3O5- MolecularWeight: 334.3471

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC2=C(C=C1)NC(C(=O)NC2)CC(=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC2=C(C=C1)NC(C(=O)NC2)CC(=O)[O-]

InChI

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