tert-butyl N-[7-methyl-1-(3-methylbut-2-enoyl)-4-oxidanylidene-3,5-dihydro-2H-1,5-benzodiazepin-3-yl]carbamate

Systemtic Name: tert-butyl N-[7-methyl-1-(3-methylbut-2-enoyl)-4-oxidanylidene-3,5-dihydro-2H-1,5-benzodiazepin-3-yl]carbamate Openeye Name: tert-butyl N-[7-methyl-1-(3-methylbut-2-enoyl)-4-oxo-3,5-dihydro-2H-1,5-benzodiazepin-3-yl]carbamate CAS Name: N-[7-methyl-1-(3-methyl-1-oxobut-2-enyl)-4-oxo-3,5-dihydro-2H-1,5-benzodiazepin-3-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[7-methyl-1-(3-methylbut-2-enoyl)-4-oxo-3,5-dihydro-2H-1,5-benzodiazepin-3-yl]carbamate Traditional Name: N-[4-keto-7-methyl-1-(3-methylbut-2-enoyl)-3,5-dihydro-2H-1,5-benzodiazepin-3-yl]carbamic acid tert-butyl ester Formula: C20H27N3O4 MolecularWeight: 373.44608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(CC(C(=O)N2)NC(=O)OC(C)(C)C)C(=O)C=C(C)C

Isomeric SMILES

CC1=CC2=C(C=C1)N(CC(C(=O)N2)NC(=O)OC(C)(C)C)C(=O)C=C(C)C

InChI

InChI=1S/C20H27N3O4/c1-12(2)9-17(24)23-11-15(22-19(26)27-20(4,5)6)18(25)21-14-10-13(3)7-8-16(14)23/h7-10,15H,11H2,1-6H3,(H,21,25)(H,22,26)