N-(2,6-dimethylphenyl)-3-piperazin-4-ium-1-yl-propanamide

Systemtic Name: N-(2,6-dimethylphenyl)-3-piperazin-4-ium-1-yl-propanamide Openeye Name: N-(2,6-dimethylphenyl)-3-piperazin-4-ium-1-yl-propanamide CAS Name: N-(2,6-dimethylphenyl)-3-(1-piperazin-4-iumyl)propanamide IUPAC Name: N-(2,6-dimethylphenyl)-3-piperazin-4-ium-1-ylpropanamide Traditional Name: N-(2,6-dimethylphenyl)-3-piperazin-4-ium-1-yl-propionamide Formula: C15H24N3O+ MolecularWeight: 262.37056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CCN2CC[NH2+]CC2

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CCN2CC[NH2+]CC2

InChI

InChI=1S/C15H23N3O/c1-12-4-3-5-13(2)15(12)17-14(19)6-9-18-10-7-16-8-11-18/h3-5,16H,6-11H2,1-2H3,(H,17,19)/p+1