1-(1-ethylpiperidin-1-ium-4-yl)-N-[4-(3-methylphenyl)phenyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-(1-ethylpiperidin-1-ium-4-yl)-N-[4-(3-methylphenyl)phenyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-(1-ethylpiperidin-1-ium-4-yl)-N-[4-(m-tolyl)phenyl]piperidin-1-ium-4-carboxamide CAS Name: 1-(1-ethyl-4-piperidin-1-iumyl)-N-[4-(3-methylphenyl)phenyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-(1-ethylpiperidin-1-ium-4-yl)-N-[4-(3-methylphenyl)phenyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-(1-ethylpiperidin-1-ium-4-yl)-N-[4-(m-tolyl)phenyl]piperidin-1-ium-4-carboxamide Formula: C26H37N3O+2 MolecularWeight: 407.59148

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCC(CC1)[NH+]2CCC(CC2)C(=O)NC3=CC=C(C=C3)C4=CC(=CC=C4)C

Isomeric SMILES

CC[NH+]1CCC(CC1)[NH+]2CCC(CC2)C(=O)NC3=CC=C(C=C3)C4=CC(=CC=C4)C

InChI

InChI=1S/C26H35N3O/c1-3-28-15-13-25(14-16-28)29-17-11-22(12-18-29)26(30)27-24-9-7-21(8-10-24)23-6-4-5-20(2)19-23/h4-10,19,22,25H,3,11-18H2,1-2H3,(H,27,30)/p+2