1-[2-[(3-chloranyl-2,6-diethyl-phenyl)amino]-2-oxidanylidene-ethyl]-N-(2-hydroxyphenyl)piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[2-[(3-chloranyl-2,6-diethyl-phenyl)amino]-2-oxidanylidene-ethyl]-N-(2-hydroxyphenyl)piperidin-1-ium-4-carboxamide Openeye Name: 1-[2-(3-chloro-2,6-diethyl-anilino)-2-oxo-ethyl]-N-(2-hydroxyphenyl)piperidin-1-ium-4-carboxamide CAS Name: 1-[2-(3-chloro-2,6-diethylanilino)-2-oxoethyl]-N-(2-hydroxyphenyl)-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[2-(3-chloro-2,6-diethylanilino)-2-oxoethyl]-N-(2-hydroxyphenyl)piperidin-1-ium-4-carboxamide Traditional Name: 1-[2-(3-chloro-2,6-diethyl-anilino)-2-keto-ethyl]-N-(2-hydroxyphenyl)piperidin-1-ium-4-carboxamide Formula: C24H31ClN3O3+ MolecularWeight: 444.97424

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C=C1)Cl)CC)NC(=O)C[NH+]2CCC(CC2)C(=O)NC3=CC=CC=C3O

Isomeric SMILES

CCC1=C(C(=C(C=C1)Cl)CC)NC(=O)C[NH+]2CCC(CC2)C(=O)NC3=CC=CC=C3O

InChI

InChI=1S/C24H30ClN3O3/c1-3-16-9-10-19(25)18(4-2)23(16)27-22(30)15-28-13-11-17(12-14-28)24(31)26-20-7-5-6-8-21(20)29/h5-10,17,29H,3-4,11-15H2,1-2H3,(H,26,31)(H,27,30)/p+1