N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-2H-chromene-3-carboxamide

Systemtic Name: N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-2H-chromene-3-carboxamide Openeye Name: N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-2H-chromene-3-carboxamide CAS Name: N-[2-methyl-4-(4-methyl-1-piperazin-4-iumyl)phenyl]-2H-1-benzopyran-3-carboxamide IUPAC Name: N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-2H-chromene-3-carboxamide Traditional Name: N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-2H-chromene-3-carboxamide Formula: C22H26N3O2+ MolecularWeight: 364.46074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CC[NH+](CC2)C)NC(=O)C3=CC4=CC=CC=C4OC3

Isomeric SMILES

CC1=C(C=CC(=C1)N2CC[NH+](CC2)C)NC(=O)C3=CC4=CC=CC=C4OC3

InChI

InChI=1S/C22H25N3O2/c1-16-13-19(25-11-9-24(2)10-12-25)7-8-20(16)23-22(26)18-14-17-5-3-4-6-21(17)27-15-18/h3-8,13-14H,9-12,15H2,1-2H3,(H,23,26)/p+1