N-(3-chloranyl-4-methoxy-phenyl)-3-[(3R)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-1-ium-3-yl]propanamide

Systemtic Name: N-(3-chloranyl-4-methoxy-phenyl)-3-[(3R)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-1-ium-3-yl]propanamide Openeye Name: N-(3-chloro-4-methoxy-phenyl)-3-[(3R)-1-indan-2-ylpiperidin-1-ium-3-yl]propanamide CAS Name: N-(3-chloro-4-methoxyphenyl)-3-[(3R)-1-(2,3-dihydro-1H-inden-2-yl)-3-piperidin-1-iumyl]propanamide IUPAC Name: N-(3-chloro-4-methoxyphenyl)-3-[(3R)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-1-ium-3-yl]propanamide Traditional Name: N-(3-chloro-4-methoxy-phenyl)-3-[(3R)-1-indan-2-ylpiperidin-1-ium-3-yl]propionamide Formula: C24H30ClN2O2+ MolecularWeight: 413.9602

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CCC2CCC[NH+](C2)C3CC4=CC=CC=C4C3)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CC[C@H]2CCC[NH+](C2)C3CC4=CC=CC=C4C3)Cl

InChI

InChI=1S/C24H29ClN2O2/c1-29-23-10-9-20(15-22(23)25)26-24(28)11-8-17-5-4-12-27(16-17)21-13-18-6-2-3-7-19(18)14-21/h2-3,6-7,9-10,15,17,21H,4-5,8,11-14,16H2,1H3,(H,26,28)/p+1/t17-/m1/s1