N-[2,6-di(propan-2-yl)phenyl]-4-(pyrrolidin-1-ium-1-ylmethyl)benzamide

Systemtic Name: N-[2,6-di(propan-2-yl)phenyl]-4-(pyrrolidin-1-ium-1-ylmethyl)benzamide Openeye Name: N-(2,6-diisopropylphenyl)-4-(pyrrolidin-1-ium-1-ylmethyl)benzamide CAS Name: N-[2,6-di(propan-2-yl)phenyl]-4-(1-pyrrolidin-1-iumylmethyl)benzamide IUPAC Name: N-[2,6-di(propan-2-yl)phenyl]-4-(pyrrolidin-1-ium-1-ylmethyl)benzamide Traditional Name: N-(2,6-diisopropylphenyl)-4-(pyrrolidin-1-ium-1-ylmethyl)benzamide Formula: C24H33N2O+ MolecularWeight: 365.53162

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)C2=CC=C(C=C2)C[NH+]3CCCC3

Isomeric SMILES

CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)C2=CC=C(C=C2)C[NH+]3CCCC3

InChI

InChI=1S/C24H32N2O/c1-17(2)21-8-7-9-22(18(3)4)23(21)25-24(27)20-12-10-19(11-13-20)16-26-14-5-6-15-26/h7-13,17-18H,5-6,14-16H2,1-4H3,(H,25,27)/p+1