methyl 2-[[[2-(tert-butylamino)-2-oxidanylidene-ethyl]-methyl-amino]methyl]-4-methyl-quinoline-3-carboxylate

Systemtic Name: methyl 2-[[[2-(tert-butylamino)-2-oxidanylidene-ethyl]-methyl-amino]methyl]-4-methyl-quinoline-3-carboxylate Openeye Name: methyl 2-[[[2-(tert-butylamino)-2-oxo-ethyl]-methyl-amino]methyl]-4-methyl-quinoline-3-carboxylate CAS Name: 2-[[[2-(tert-butylamino)-2-oxoethyl]-methylamino]methyl]-4-methyl-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[[[2-(tert-butylamino)-2-oxoethyl]-methylamino]methyl]-4-methylquinoline-3-carboxylate Traditional Name: 2-[[[2-(tert-butylamino)-2-keto-ethyl]-methyl-amino]methyl]-4-methyl-quinoline-3-carboxylic acid methyl ester Formula: C20H27N3O3 MolecularWeight: 357.44668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)CN(C)CC(=O)NC(C)(C)C)C(=O)OC

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)CN(C)CC(=O)NC(C)(C)C)C(=O)OC

InChI

InChI=1S/C20H27N3O3/c1-13-14-9-7-8-10-15(14)21-16(18(13)19(25)26-6)11-23(5)12-17(24)22-20(2,3)4/h7-10H,11-12H2,1-6H3,(H,22,24)