N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-propoxy-benzamide

Systemtic Name: N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-propoxy-benzamide Openeye Name: N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-propoxy-benzamide CAS Name: N-[4-(4-methyl-1-piperazin-4-iumyl)phenyl]-3-propoxybenzamide IUPAC Name: N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-propoxybenzamide Traditional Name: N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-propoxy-benzamide Formula: C21H28N3O2+ MolecularWeight: 354.46592

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)N3CC[NH+](CC3)C

Isomeric SMILES

CCCOC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)N3CC[NH+](CC3)C

InChI

InChI=1S/C21H27N3O2/c1-3-15-26-20-6-4-5-17(16-20)21(25)22-18-7-9-19(10-8-18)24-13-11-23(2)12-14-24/h4-10,16H,3,11-15H2,1-2H3,(H,22,25)/p+1