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4-(dimethylamino)-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]benzamide

4-(dimethylamino)-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]benzamide

Systemtic Name:4-(dimethylamino)-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]benzamide
Openeye Name:4-(dimethylamino)-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]benzamide
CAS Name:4-(dimethylamino)-N-[(3S)-1-phenethyl-3-piperidin-1-iumyl]benzamide
IUPAC Name:4-(dimethylamino)-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]benzamide
Traditional Name:4-(dimethylamino)-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]benzamide
Formula: C22H30N3O+
MolecularWeight: 352.4931
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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(=O)NC2CCC[NH+](C2)CCC3=CC=CC=C3


Isomeric SMILES

CN(C)C1=CC=C(C=C1)C(=O)N[C@H]2CCC[NH+](C2)CCC3=CC=CC=C3


InChI

InChI=1S/C22H29N3O/c1-24(2)21-12-10-19(11-13-21)22(26)23-20-9-6-15-25(17-20)16-14-18-7-4-3-5-8-18/h3-5,7-8,10-13,20H,6,9,14-17H2,1-2H3,(H,23,26)/p+1/t20-/m0/s1


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