N-[(5-chloranylthiophen-2-yl)methyl]-4-methoxy-3-(1-propan-2-ylpiperidin-1-ium-4-yl)oxy-benzamide

Systemtic Name: N-[(5-chloranylthiophen-2-yl)methyl]-4-methoxy-3-(1-propan-2-ylpiperidin-1-ium-4-yl)oxy-benzamide Openeye Name: N-[(5-chloro-2-thienyl)methyl]-3-(1-isopropylpiperidin-1-ium-4-yl)oxy-4-methoxy-benzamide CAS Name: N-[(5-chloro-2-thiophenyl)methyl]-4-methoxy-3-[(1-propan-2-yl-4-piperidin-1-iumyl)oxy]benzamide IUPAC Name: N-[(5-chlorothiophen-2-yl)methyl]-4-methoxy-3-(1-propan-2-ylpiperidin-1-ium-4-yl)oxybenzamide Traditional Name: N-[(5-chloro-2-thienyl)methyl]-3-(1-isopropylpiperidin-1-ium-4-yl)oxy-4-methoxy-benzamide Formula: C21H28ClN2O3S+ MolecularWeight: 423.97662

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCC(CC1)OC2=C(C=CC(=C2)C(=O)NCC3=CC=C(S3)Cl)OC

Isomeric SMILES

CC(C)[NH+]1CCC(CC1)OC2=C(C=CC(=C2)C(=O)NCC3=CC=C(S3)Cl)OC

InChI

InChI=1S/C21H27ClN2O3S/c1-14(2)24-10-8-16(9-11-24)27-19-12-15(4-6-18(19)26-3)21(25)23-13-17-5-7-20(22)28-17/h4-7,12,14,16H,8-11,13H2,1-3H3,(H,23,25)/p+1