tert-butyl N-[1-(1,3-benzodioxol-5-ylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[1-(1,3-benzodioxol-5-ylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate Openeye Name: tert-butyl N-[2-(1,3-benzodioxol-5-ylamino)-1-benzyl-2-oxo-ethyl]carbamate CAS Name: N-[1-(1,3-benzodioxol-5-ylamino)-1-oxo-3-phenylpropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-(1,3-benzodioxol-5-ylamino)-1-oxo-3-phenylpropan-2-yl]carbamate Traditional Name: N-[2-(1,3-benzodioxol-5-ylamino)-1-benzyl-2-keto-ethyl]carbamic acid tert-butyl ester Formula: C21H24N2O5 MolecularWeight: 384.42566

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(=O)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(=O)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C21H24N2O5/c1-21(2,3)28-20(25)23-16(11-14-7-5-4-6-8-14)19(24)22-15-9-10-17-18(12-15)27-13-26-17/h4-10,12,16H,11,13H2,1-3H3,(H,22,24)(H,23,25)