tert-butyl N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylcarbamoyl)phenyl]carbamate

Systemtic Name: tert-butyl N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylcarbamoyl)phenyl]carbamate Openeye Name: tert-butyl N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylcarbamoyl)phenyl]carbamate CAS Name: N-[4-[(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-oxomethyl]phenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylcarbamoyl)phenyl]carbamate Traditional Name: N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylcarbamoyl)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=C(C=C1)C(=O)NC2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C21H24N2O5/c1-21(2,3)28-20(25)23-15-7-5-14(6-8-15)19(24)22-16-9-10-17-18(13-16)27-12-4-11-26-17/h5-10,13H,4,11-12H2,1-3H3,(H,22,24)(H,23,25)