tert-butyl N-[7-oxidanylidene-1-(phenylmethyl)-5,6-dihydro-2H-azepin-6-yl]carbamate

Systemtic Name: tert-butyl N-[7-oxidanylidene-1-(phenylmethyl)-5,6-dihydro-2H-azepin-6-yl]carbamate Openeye Name: tert-butyl N-(1-benzyl-7-oxo-5,6-dihydro-2H-azepin-6-yl)carbamate CAS Name: N-[7-oxo-1-(phenylmethyl)-5,6-dihydro-2H-azepin-6-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(1-benzyl-7-oxo-5,6-dihydro-2H-azepin-6-yl)carbamate Traditional Name: N-(1-benzyl-7-keto-5,6-dihydro-2H-azepin-6-yl)carbamic acid tert-butyl ester Formula: C18H24N2O3 MolecularWeight: 316.39476

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1CC=CCN(C1=O)CC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)NC1CC=CCN(C1=O)CC2=CC=CC=C2

InChI

InChI=1S/C18H24N2O3/c1-18(2,3)23-17(22)19-15-11-7-8-12-20(16(15)21)13-14-9-5-4-6-10-14/h4-10,15H,11-13H2,1-3H3,(H,19,22)