3-(azepan-1-ium-1-ylmethyl)-N,8-dimethyl-N-phenethyl-imidazo[1,2-a]pyridine-2-carboxamide

Systemtic Name: 3-(azepan-1-ium-1-ylmethyl)-N,8-dimethyl-N-phenethyl-imidazo[1,2-a]pyridine-2-carboxamide Openeye Name: 3-(azepan-1-ium-1-ylmethyl)-N,8-dimethyl-N-phenethyl-imidazo[1,2-a]pyridine-2-carboxamide CAS Name: 3-(1-azepan-1-iumylmethyl)-N,8-dimethyl-N-phenethyl-2-imidazo[1,2-a]pyridinecarboxamide IUPAC Name: 3-(azepan-1-ium-1-ylmethyl)-N,8-dimethyl-N-phenethylimidazo[1,2-a]pyridine-2-carboxamide Traditional Name: 3-(azepan-1-ium-1-ylmethyl)-N,8-dimethyl-N-phenethyl-imidazo[1,2-a]pyridine-2-carboxamide Formula: C25H33N4O+ MolecularWeight: 405.55572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CN2C1=NC(=C2C[NH+]3CCCCCC3)C(=O)N(C)CCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=CN2C1=NC(=C2C[NH+]3CCCCCC3)C(=O)N(C)CCC4=CC=CC=C4

InChI

InChI=1S/C25H32N4O/c1-20-11-10-17-29-22(19-28-15-8-3-4-9-16-28)23(26-24(20)29)25(30)27(2)18-14-21-12-6-5-7-13-21/h5-7,10-13,17H,3-4,8-9,14-16,18-19H2,1-2H3/p+1