tert-butyl N-[3-(2,3-dihydro-1,4-benzodioxin-6-ylmethylcarbamoyl)phenyl]carbamate

Systemtic Name: tert-butyl N-[3-(2,3-dihydro-1,4-benzodioxin-6-ylmethylcarbamoyl)phenyl]carbamate Openeye Name: tert-butyl N-[3-(2,3-dihydro-1,4-benzodioxin-6-ylmethylcarbamoyl)phenyl]carbamate CAS Name: N-[3-[(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)-oxomethyl]phenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-(2,3-dihydro-1,4-benzodioxin-6-ylmethylcarbamoyl)phenyl]carbamate Traditional Name: N-[3-(2,3-dihydro-1,4-benzodioxin-6-ylmethylcarbamoyl)phenyl]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)NC1=CC=CC(=C1)C(=O)NCC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC=CC(=C1)C(=O)NCC2=CC3=C(C=C2)OCCO3

InChI

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