N'-(3,4-dimethylphenyl)-N-[(1-propan-2-ylpiperidin-1-ium-4-yl)methyl]ethanediamide

Systemtic Name: N'-(3,4-dimethylphenyl)-N-[(1-propan-2-ylpiperidin-1-ium-4-yl)methyl]ethanediamide Openeye Name: N'-(3,4-dimethylphenyl)-N-[(1-isopropylpiperidin-1-ium-4-yl)methyl]oxamide CAS Name: N'-(3,4-dimethylphenyl)-N-[(1-propan-2-yl-4-piperidin-1-iumyl)methyl]oxamide IUPAC Name: N'-(3,4-dimethylphenyl)-N-[(1-propan-2-ylpiperidin-1-ium-4-yl)methyl]oxamide Traditional Name: N'-(3,4-dimethylphenyl)-N-[(1-isopropylpiperidin-1-ium-4-yl)methyl]oxamide Formula: C19H30N3O2+ MolecularWeight: 332.4604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(=O)NCC2CC[NH+](CC2)C(C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C(=O)NCC2CC[NH+](CC2)C(C)C)C

InChI

InChI=1S/C19H29N3O2/c1-13(2)22-9-7-16(8-10-22)12-20-18(23)19(24)21-17-6-5-14(3)15(4)11-17/h5-6,11,13,16H,7-10,12H2,1-4H3,(H,20,23)(H,21,24)/p+1