5-chloranyl-2-methoxy-4-(methylamino)-N-[(2S,3R)-2-methyl-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]benzamide

Systemtic Name: 5-chloranyl-2-methoxy-4-(methylamino)-N-[(2S,3R)-2-methyl-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]benzamide Openeye Name: N-[(2S,3R)-1-benzyl-2-methyl-pyrrolidin-1-ium-3-yl]-5-chloro-2-methoxy-4-(methylamino)benzamide CAS Name: 5-chloro-2-methoxy-4-(methylamino)-N-[(2S,3R)-2-methyl-1-(phenylmethyl)-3-pyrrolidin-1-iumyl]benzamide IUPAC Name: N-[(2S,3R)-1-benzyl-2-methylpyrrolidin-1-ium-3-yl]-5-chloro-2-methoxy-4-(methylamino)benzamide Traditional Name: N-[(2S,3R)-1-benzyl-2-methyl-pyrrolidin-1-ium-3-yl]-5-chloro-2-methoxy-4-(methylamino)benzamide Formula: C21H27ClN3O2+ MolecularWeight: 388.91098

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(CC[NH+]1CC2=CC=CC=C2)NC(=O)C3=CC(=C(C=C3OC)NC)Cl

Isomeric SMILES

C[C@H]1[C@@H](CC[NH+]1CC2=CC=CC=C2)NC(=O)C3=CC(=C(C=C3OC)NC)Cl

InChI

InChI=1S/C21H26ClN3O2/c1-14-18(9-10-25(14)13-15-7-5-4-6-8-15)24-21(26)16-11-17(22)19(23-2)12-20(16)27-3/h4-8,11-12,14,18,23H,9-10,13H2,1-3H3,(H,24,26)/p+1/t14-,18+/m0/s1