tert-butyl N-[4-[(1,3-benzodioxol-5-ylcarbonylamino)carbamoyl]phenyl]carbamate

Systemtic Name: tert-butyl N-[4-[(1,3-benzodioxol-5-ylcarbonylamino)carbamoyl]phenyl]carbamate Openeye Name: tert-butyl N-[4-[(1,3-benzodioxole-5-carbonylamino)carbamoyl]phenyl]carbamate CAS Name: N-[4-[[[1,3-benzodioxol-5-yl(oxo)methyl]hydrazo]-oxomethyl]phenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[(1,3-benzodioxole-5-carbonylamino)carbamoyl]phenyl]carbamate Traditional Name: N-[4-[(piperonyloylamino)carbamoyl]phenyl]carbamic acid tert-butyl ester Formula: C20H21N3O6 MolecularWeight: 399.39724

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC=C(C=C1)C(=O)NNC(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC=C(C=C1)C(=O)NNC(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C20H21N3O6/c1-20(2,3)29-19(26)21-14-7-4-12(5-8-14)17(24)22-23-18(25)13-6-9-15-16(10-13)28-11-27-15/h4-10H,11H2,1-3H3,(H,21,26)(H,22,24)(H,23,25)