3-[(3S)-1-[(7-chloranyl-3-methyl-1H-indol-2-yl)methyl]piperidin-1-ium-3-yl]-N-cyclopropyl-propanamide

Systemtic Name: 3-[(3S)-1-[(7-chloranyl-3-methyl-1H-indol-2-yl)methyl]piperidin-1-ium-3-yl]-N-cyclopropyl-propanamide Openeye Name: 3-[(3S)-1-[(7-chloro-3-methyl-1H-indol-2-yl)methyl]piperidin-1-ium-3-yl]-N-cyclopropyl-propanamide CAS Name: 3-[(3S)-1-[(7-chloro-3-methyl-1H-indol-2-yl)methyl]-3-piperidin-1-iumyl]-N-cyclopropylpropanamide IUPAC Name: 3-[(3S)-1-[(7-chloro-3-methyl-1H-indol-2-yl)methyl]piperidin-1-ium-3-yl]-N-cyclopropylpropanamide Traditional Name: 3-[(3S)-1-[(7-chloro-3-methyl-1H-indol-2-yl)methyl]piperidin-1-ium-3-yl]-N-cyclopropyl-propionamide Formula: C21H29ClN3O+ MolecularWeight: 374.92746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=C1C=CC=C2Cl)C[NH+]3CCCC(C3)CCC(=O)NC4CC4

Isomeric SMILES

CC1=C(NC2=C1C=CC=C2Cl)C[NH+]3CCC[C@H](C3)CCC(=O)NC4CC4

InChI

InChI=1S/C21H28ClN3O/c1-14-17-5-2-6-18(22)21(17)24-19(14)13-25-11-3-4-15(12-25)7-10-20(26)23-16-8-9-16/h2,5-6,15-16,24H,3-4,7-13H2,1H3,(H,23,26)/p+1/t15-/m0/s1