tert-butyl N-[1-[(3-chlorophenyl)methyl]-7-oxidanylidene-5,6-dihydro-2H-azepin-6-yl]carbamate

Systemtic Name: tert-butyl N-[1-[(3-chlorophenyl)methyl]-7-oxidanylidene-5,6-dihydro-2H-azepin-6-yl]carbamate Openeye Name: tert-butyl N-[1-[(3-chlorophenyl)methyl]-7-oxo-5,6-dihydro-2H-azepin-6-yl]carbamate CAS Name: N-[1-[(3-chlorophenyl)methyl]-7-oxo-5,6-dihydro-2H-azepin-6-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-[(3-chlorophenyl)methyl]-7-oxo-5,6-dihydro-2H-azepin-6-yl]carbamate Traditional Name: N-[1-(3-chlorobenzyl)-7-keto-5,6-dihydro-2H-azepin-6-yl]carbamic acid tert-butyl ester Formula: C18H23ClN2O3 MolecularWeight: 350.83982

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23ClN2O3/c1-18(2,3)24-17(23)20-15-9-4-5-10-21(16(15)22)12-13-7-6-8-14(19)11-13/h4-8,11,15H,9-10,12H2,1-3H3,(H,20,23)