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

Systemtic Name: tert-butyl N-[1-(1,3-benzodioxol-5-ylamino)-1-oxidanylidene-3-phenylmethoxy-propan-2-yl]carbamate Openeye Name: tert-butyl N-[2-(1,3-benzodioxol-5-ylamino)-1-(benzyloxymethyl)-2-oxo-ethyl]carbamate CAS Name: N-[1-(1,3-benzodioxol-5-ylamino)-1-oxo-3-phenylmethoxypropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-(1,3-benzodioxol-5-ylamino)-1-oxo-3-phenylmethoxypropan-2-yl]carbamate Traditional Name: N-[2-(1,3-benzodioxol-5-ylamino)-1-(benzoxymethyl)-2-keto-ethyl]carbamic acid tert-butyl ester Formula: C22H26N2O6 MolecularWeight: 414.45164

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(COCC1=CC=CC=C1)C(=O)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(C)(C)OC(=O)NC(COCC1=CC=CC=C1)C(=O)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C22H26N2O6/c1-22(2,3)30-21(26)24-17(13-27-12-15-7-5-4-6-8-15)20(25)23-16-9-10-18-19(11-16)29-14-28-18/h4-11,17H,12-14H2,1-3H3,(H,23,25)(H,24,26)