N-ethyl-N-(phenylmethyl)-1-[(4-propan-2-ylphenyl)methyl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-ethyl-N-(phenylmethyl)-1-[(4-propan-2-ylphenyl)methyl]piperidin-1-ium-4-carboxamide Openeye Name: N-benzyl-N-ethyl-1-[(4-isopropylphenyl)methyl]piperidin-1-ium-4-carboxamide CAS Name: N-ethyl-N-(phenylmethyl)-1-[(4-propan-2-ylphenyl)methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-benzyl-N-ethyl-1-[(4-propan-2-ylphenyl)methyl]piperidin-1-ium-4-carboxamide Traditional Name: N-benzyl-N-ethyl-1-(4-isopropylbenzyl)piperidin-1-ium-4-carboxamide Formula: C25H35N2O+ MolecularWeight: 379.5582

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)C(=O)C2CC[NH+](CC2)CC3=CC=C(C=C3)C(C)C

Isomeric SMILES

CCN(CC1=CC=CC=C1)C(=O)C2CC[NH+](CC2)CC3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C25H34N2O/c1-4-27(19-21-8-6-5-7-9-21)25(28)24-14-16-26(17-15-24)18-22-10-12-23(13-11-22)20(2)3/h5-13,20,24H,4,14-19H2,1-3H3/p+1