tert-butyl 2-[3-azanyl-1-(2,2-dimethylpropanoyl)-4-oxidanylidene-2,3-dihydro-1,5-benzodiazepin-5-yl]ethanoate

Systemtic Name: tert-butyl 2-[3-azanyl-1-(2,2-dimethylpropanoyl)-4-oxidanylidene-2,3-dihydro-1,5-benzodiazepin-5-yl]ethanoate Openeye Name: tert-butyl 2-[3-amino-1-(2,2-dimethylpropanoyl)-4-oxo-2,3-dihydro-1,5-benzodiazepin-5-yl]acetate CAS Name: 2-[3-amino-1-(2,2-dimethyl-1-oxopropyl)-4-oxo-2,3-dihydro-1,5-benzodiazepin-5-yl]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[3-amino-1-(2,2-dimethylpropanoyl)-4-oxo-2,3-dihydro-1,5-benzodiazepin-5-yl]acetate Traditional Name: 2-(3-amino-4-keto-1-pivaloyl-2,3-dihydro-1,5-benzodiazepin-5-yl)acetic acid tert-butyl ester Formula: C20H29N3O4 MolecularWeight: 375.46196

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)N1CC(C(=O)N(C2=CC=CC=C21)CC(=O)OC(C)(C)C)N

Isomeric SMILES

CC(C)(C)C(=O)N1CC(C(=O)N(C2=CC=CC=C21)CC(=O)OC(C)(C)C)N

InChI

InChI=1S/C20H29N3O4/c1-19(2,3)18(26)23-11-13(21)17(25)22(12-16(24)27-20(4,5)6)14-9-7-8-10-15(14)23/h7-10,13H,11-12,21H2,1-6H3