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

Systemtic Name: tert-butyl N-[1-methyl-4-(phenylmethyl)-1,4-diazepan-6-yl]carbamate Openeye Name: tert-butyl N-(1-benzyl-4-methyl-1,4-diazepan-6-yl)carbamate CAS Name: N-[1-methyl-4-(phenylmethyl)-1,4-diazepan-6-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(1-benzyl-4-methyl-1,4-diazepan-6-yl)carbamate Traditional Name: N-(1-benzyl-4-methyl-1,4-diazepan-6-yl)carbamic acid tert-butyl ester Formula: C18H29N3O2 MolecularWeight: 319.44176

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H29N3O2/c1-18(2,3)23-17(22)19-16-13-20(4)10-11-21(14-16)12-15-8-6-5-7-9-15/h5-9,16H,10-14H2,1-4H3,(H,19,22)