tert-butyl N-[1-methyl-5-oxidanylidene-4-(phenylmethyl)-1,4-diazepan-6-yl]carbamate

Systemtic Name: tert-butyl N-[1-methyl-5-oxidanylidene-4-(phenylmethyl)-1,4-diazepan-6-yl]carbamate Openeye Name: tert-butyl N-(4-benzyl-1-methyl-5-oxo-1,4-diazepan-6-yl)carbamate CAS Name: N-[1-methyl-5-oxo-4-(phenylmethyl)-1,4-diazepan-6-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(4-benzyl-1-methyl-5-oxo-1,4-diazepan-6-yl)carbamate Traditional Name: N-(4-benzyl-5-keto-1-methyl-1,4-diazepan-6-yl)carbamic acid tert-butyl ester Formula: C18H27N3O3 MolecularWeight: 333.42528

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1CN(CCN(C1=O)CC2=CC=CC=C2)C

Isomeric SMILES

CC(C)(C)OC(=O)NC1CN(CCN(C1=O)CC2=CC=CC=C2)C

InChI

InChI=1S/C18H27N3O3/c1-18(2,3)24-17(23)19-15-13-20(4)10-11-21(16(15)22)12-14-8-6-5-7-9-14/h5-9,15H,10-13H2,1-4H3,(H,19,23)