N-(2,3-dimethylphenyl)-4-(pyridin-4-ylmethyl)piperazin-4-ium-1-carboxamide

Systemtic Name: N-(2,3-dimethylphenyl)-4-(pyridin-4-ylmethyl)piperazin-4-ium-1-carboxamide Openeye Name: N-(2,3-dimethylphenyl)-4-(4-pyridylmethyl)piperazin-4-ium-1-carboxamide CAS Name: N-(2,3-dimethylphenyl)-4-(pyridin-4-ylmethyl)-1-piperazin-4-iumcarboxamide IUPAC Name: N-(2,3-dimethylphenyl)-4-(pyridin-4-ylmethyl)piperazin-4-ium-1-carboxamide Traditional Name: N-(2,3-dimethylphenyl)-4-(4-pyridylmethyl)piperazin-4-ium-1-carboxamide Formula: C19H25N4O+ MolecularWeight: 325.428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)N2CC[NH+](CC2)CC3=CC=NC=C3)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)N2CC[NH+](CC2)CC3=CC=NC=C3)C

InChI

InChI=1S/C19H24N4O/c1-15-4-3-5-18(16(15)2)21-19(24)23-12-10-22(11-13-23)14-17-6-8-20-9-7-17/h3-9H,10-14H2,1-2H3,(H,21,24)/p+1