6-methyl-2-[(4-methylphenoxy)methyl]-1-(2-morpholin-4-ium-4-ylethyl)-4-oxidanylidene-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide

Systemtic Name: 6-methyl-2-[(4-methylphenoxy)methyl]-1-(2-morpholin-4-ium-4-ylethyl)-4-oxidanylidene-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide Openeye Name: 6-methyl-2-[(4-methylphenoxy)methyl]-1-(2-morpholin-4-ium-4-ylethyl)-4-oxo-N-(3-pyridylmethyl)pyridine-3-carboxamide CAS Name: 6-methyl-2-[(4-methylphenoxy)methyl]-1-[2-(4-morpholin-4-iumyl)ethyl]-4-oxo-N-(3-pyridinylmethyl)-3-pyridinecarboxamide IUPAC Name: 6-methyl-2-[(4-methylphenoxy)methyl]-1-(2-morpholin-4-ium-4-ylethyl)-4-oxo-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide Traditional Name: 4-keto-6-methyl-2-[(4-methylphenoxy)methyl]-1-(2-morpholin-4-ium-4-ylethyl)-N-(3-pyridylmethyl)nicotinamide Formula: C27H33N4O4+ MolecularWeight: 477.57532

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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)NCC4=CN=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)OCC2=C(C(=O)C=C(N2CC[NH+]3CCOCC3)C)C(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C27H32N4O4/c1-20-5-7-23(8-6-20)35-19-24-26(27(33)29-18-22-4-3-9-28-17-22)25(32)16-21(2)31(24)11-10-30-12-14-34-15-13-30/h3-9,16-17H,10-15,18-19H2,1-2H3,(H,29,33)/p+1