methyl 5-[[4-[2-(dimethylamino)-2-oxidanylidene-ethyl]-1,4-diazepan-1-yl]methyl]-3-methyl-furan-2-carboxylate

Systemtic Name: methyl 5-[[4-[2-(dimethylamino)-2-oxidanylidene-ethyl]-1,4-diazepan-1-yl]methyl]-3-methyl-furan-2-carboxylate Openeye Name: methyl 5-[[4-[2-(dimethylamino)-2-oxo-ethyl]-1,4-diazepan-1-yl]methyl]-3-methyl-furan-2-carboxylate CAS Name: 5-[[4-[2-(dimethylamino)-2-oxoethyl]-1,4-diazepan-1-yl]methyl]-3-methyl-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[4-[2-(dimethylamino)-2-oxoethyl]-1,4-diazepan-1-yl]methyl]-3-methylfuran-2-carboxylate Traditional Name: 5-[[4-[2-(dimethylamino)-2-keto-ethyl]-1,4-diazepan-1-yl]methyl]-3-methyl-furan-2-carboxylic acid methyl ester Formula: C17H27N3O4 MolecularWeight: 337.41398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=C1)CN2CCCN(CC2)CC(=O)N(C)C)C(=O)OC

Isomeric SMILES

CC1=C(OC(=C1)CN2CCCN(CC2)CC(=O)N(C)C)C(=O)OC

InChI

InChI=1S/C17H27N3O4/c1-13-10-14(24-16(13)17(22)23-4)11-19-6-5-7-20(9-8-19)12-15(21)18(2)3/h10H,5-9,11-12H2,1-4H3