[(1-methyl-1,2,3,6-tetrahydropyridin-1-ium-4-yl)amino] 4-chloranylbenzoate

Systemtic Name: [(1-methyl-1,2,3,6-tetrahydropyridin-1-ium-4-yl)amino] 4-chloranylbenzoate Openeye Name: [(1-methyl-1,2,3,6-tetrahydropyridin-1-ium-4-yl)amino] 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid [(1-methyl-1,2,3,6-tetrahydropyridin-1-ium-4-yl)amino] ester IUPAC Name: [(1-methyl-1,2,3,6-tetrahydropyridin-1-ium-4-yl)amino] 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid [(1-methyl-1,2,3,6-tetrahydropyridin-1-ium-4-yl)amino] ester Formula: C13H16ClN2O2+ MolecularWeight: 267.73134

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(=CC1)NOC(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

C[NH+]1CCC(=CC1)NOC(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C13H15ClN2O2/c1-16-8-6-12(7-9-16)15-18-13(17)10-2-4-11(14)5-3-10/h2-6,15H,7-9H2,1H3/p+1