N-[(4-chlorophenyl)methyl]-1-methyl-6-[[methyl-(2-oxidanyl-2-phenyl-ethyl)amino]methyl]-4-oxidanylidene-quinoline-3-carboxamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-1-methyl-6-[[methyl-(2-oxidanyl-2-phenyl-ethyl)amino]methyl]-4-oxidanylidene-quinoline-3-carboxamide Openeye Name: N-[(4-chlorophenyl)methyl]-6-[[(2-hydroxy-2-phenyl-ethyl)-methyl-amino]methyl]-1-methyl-4-oxo-quinoline-3-carboxamide CAS Name: N-[(4-chlorophenyl)methyl]-6-[[(2-hydroxy-2-phenylethyl)-methylamino]methyl]-1-methyl-4-oxo-3-quinolinecarboxamide IUPAC Name: N-[(4-chlorophenyl)methyl]-6-[[(2-hydroxy-2-phenylethyl)-methylamino]methyl]-1-methyl-4-oxoquinoline-3-carboxamide Traditional Name: N-(4-chlorobenzyl)-6-[[(2-hydroxy-2-phenyl-ethyl)-methyl-amino]methyl]-4-keto-1-methyl-quinoline-3-carboxamide Formula: C28H28ClN3O3 MolecularWeight: 489.99322

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=O)C2=C1C=CC(=C2)CN(C)CC(C3=CC=CC=C3)O)C(=O)NCC4=CC=C(C=C4)Cl

Isomeric SMILES

CN1C=C(C(=O)C2=C1C=CC(=C2)CN(C)CC(C3=CC=CC=C3)O)C(=O)NCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C28H28ClN3O3/c1-31(18-26(33)21-6-4-3-5-7-21)16-20-10-13-25-23(14-20)27(34)24(17-32(25)2)28(35)30-15-19-8-11-22(29)12-9-19/h3-14,17,26,33H,15-16,18H2,1-2H3,(H,30,35)