2-[2-chloranylethanoyl-[(2-methoxyphenyl)methyl]amino]-N-cyclohexyl-2-pyridin-1-ium-4-yl-ethanamide

Systemtic Name: 2-[2-chloranylethanoyl-[(2-methoxyphenyl)methyl]amino]-N-cyclohexyl-2-pyridin-1-ium-4-yl-ethanamide Openeye Name: 2-[(2-chloroacetyl)-[(2-methoxyphenyl)methyl]amino]-N-cyclohexyl-2-pyridin-1-ium-4-yl-acetamide CAS Name: 2-[(2-chloro-1-oxoethyl)-[(2-methoxyphenyl)methyl]amino]-N-cyclohexyl-2-(4-pyridin-1-iumyl)acetamide IUPAC Name: 2-[(2-chloroacetyl)-[(2-methoxyphenyl)methyl]amino]-N-cyclohexyl-2-pyridin-1-ium-4-ylacetamide Traditional Name: 2-[(2-chloroacetyl)-o-anisyl-amino]-N-cyclohexyl-2-pyridin-1-ium-4-yl-acetamide Formula: C23H29ClN3O3+ MolecularWeight: 430.94766

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CN(C(C2=CC=[NH+]C=C2)C(=O)NC3CCCCC3)C(=O)CCl

Isomeric SMILES

COC1=CC=CC=C1CN(C(C2=CC=[NH+]C=C2)C(=O)NC3CCCCC3)C(=O)CCl

InChI

InChI=1S/C23H28ClN3O3/c1-30-20-10-6-5-7-18(20)16-27(21(28)15-24)22(17-11-13-25-14-12-17)23(29)26-19-8-3-2-4-9-19/h5-7,10-14,19,22H,2-4,8-9,15-16H2,1H3,(H,26,29)/p+1