3-methyl-N-[4-(4-propan-2-ylpiperazin-4-ium-1-yl)phenyl]benzamide

Systemtic Name: 3-methyl-N-[4-(4-propan-2-ylpiperazin-4-ium-1-yl)phenyl]benzamide Openeye Name: N-[4-(4-isopropylpiperazin-4-ium-1-yl)phenyl]-3-methyl-benzamide CAS Name: 3-methyl-N-[4-(4-propan-2-yl-1-piperazin-4-iumyl)phenyl]benzamide IUPAC Name: 3-methyl-N-[4-(4-propan-2-ylpiperazin-4-ium-1-yl)phenyl]benzamide Traditional Name: N-[4-(4-isopropylpiperazin-4-ium-1-yl)phenyl]-3-methyl-benzamide Formula: C21H28N3O+ MolecularWeight: 338.46652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)N3CC[NH+](CC3)C(C)C

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)N3CC[NH+](CC3)C(C)C

InChI

InChI=1S/C21H27N3O/c1-16(2)23-11-13-24(14-12-23)20-9-7-19(8-10-20)22-21(25)18-6-4-5-17(3)15-18/h4-10,15-16H,11-14H2,1-3H3,(H,22,25)/p+1