2-[4-(2-methylquinolin-4-yl)-2-(morpholin-4-ium-4-ylmethyl)phenoxy]-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: 2-[4-(2-methylquinolin-4-yl)-2-(morpholin-4-ium-4-ylmethyl)phenoxy]-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: 2-[4-(2-methyl-4-quinolyl)-2-(morpholin-4-ium-4-ylmethyl)phenoxy]-N-(2-thienylmethyl)acetamide CAS Name: 2-[4-(2-methyl-4-quinolinyl)-2-(4-morpholin-4-iumylmethyl)phenoxy]-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: 2-[4-(2-methylquinolin-4-yl)-2-(morpholin-4-ium-4-ylmethyl)phenoxy]-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-[4-(2-methyl-4-quinolyl)-2-(morpholin-4-ium-4-ylmethyl)phenoxy]-N-(2-thenyl)acetamide Formula: C28H30N3O3S+ MolecularWeight: 488.6211

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)C3=CC(=C(C=C3)OCC(=O)NCC4=CC=CS4)C[NH+]5CCOCC5

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)C3=CC(=C(C=C3)OCC(=O)NCC4=CC=CS4)C[NH+]5CCOCC5

InChI

InChI=1S/C28H29N3O3S/c1-20-15-25(24-6-2-3-7-26(24)30-20)21-8-9-27(22(16-21)18-31-10-12-33-13-11-31)34-19-28(32)29-17-23-5-4-14-35-23/h2-9,14-16H,10-13,17-19H2,1H3,(H,29,32)/p+1