N,6-dimethyl-2-[(4-methylphenoxy)methyl]-1-(2-morpholin-4-ium-4-ylethyl)-4-oxidanylidene-N-(phenylmethyl)pyridine-3-carboxamide

Systemtic Name: N,6-dimethyl-2-[(4-methylphenoxy)methyl]-1-(2-morpholin-4-ium-4-ylethyl)-4-oxidanylidene-N-(phenylmethyl)pyridine-3-carboxamide Openeye Name: N-benzyl-N,6-dimethyl-2-[(4-methylphenoxy)methyl]-1-(2-morpholin-4-ium-4-ylethyl)-4-oxo-pyridine-3-carboxamide CAS Name: N,6-dimethyl-2-[(4-methylphenoxy)methyl]-1-[2-(4-morpholin-4-iumyl)ethyl]-4-oxo-N-(phenylmethyl)-3-pyridinecarboxamide IUPAC Name: N-benzyl-N,6-dimethyl-2-[(4-methylphenoxy)methyl]-1-(2-morpholin-4-ium-4-ylethyl)-4-oxopyridine-3-carboxamide Traditional Name: N-benzyl-4-keto-N,6-dimethyl-2-[(4-methylphenoxy)methyl]-1-(2-morpholin-4-ium-4-ylethyl)nicotinamide Formula: C29H36N3O4+ MolecularWeight: 490.61384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCC2=C(C(=O)C=C(N2CC[NH+]3CCOCC3)C)C(=O)N(C)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)OCC2=C(C(=O)C=C(N2CC[NH+]3CCOCC3)C)C(=O)N(C)CC4=CC=CC=C4

InChI

InChI=1S/C29H35N3O4/c1-22-9-11-25(12-10-22)36-21-26-28(29(34)30(3)20-24-7-5-4-6-8-24)27(33)19-23(2)32(26)14-13-31-15-17-35-18-16-31/h4-12,19H,13-18,20-21H2,1-3H3/p+1