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

Systemtic Name: ethyl 2-[3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-1-yl]ethanoate Openeye Name: ethyl 2-[3-(tert-butoxycarbonylamino)-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl]acetate CAS Name: 2-[3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl]acetate Traditional Name: 2-[3-(tert-butoxycarbonylamino)-2-keto-5-phenyl-3H-1,4-benzodiazepin-1-yl]acetic acid ethyl ester Formula: C24H27N3O5 MolecularWeight: 437.48828

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)OC(C)(C)C)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)OC(C)(C)C)C3=CC=CC=C3

InChI

InChI=1S/C24H27N3O5/c1-5-31-19(28)15-27-18-14-10-9-13-17(18)20(16-11-7-6-8-12-16)25-21(22(27)29)26-23(30)32-24(2,3)4/h6-14,21H,5,15H2,1-4H3,(H,26,30)