2-chloranyl-N-[2-(3-morpholin-4-ium-4-ylpropylcarbamoyl)phenyl]pyridine-3-carboxamide

Systemtic Name: 2-chloranyl-N-[2-(3-morpholin-4-ium-4-ylpropylcarbamoyl)phenyl]pyridine-3-carboxamide Openeye Name: 2-chloro-N-[2-(3-morpholin-4-ium-4-ylpropylcarbamoyl)phenyl]pyridine-3-carboxamide CAS Name: 2-chloro-N-[2-[[3-(4-morpholin-4-iumyl)propylamino]-oxomethyl]phenyl]-3-pyridinecarboxamide IUPAC Name: 2-chloro-N-[2-(3-morpholin-4-ium-4-ylpropylcarbamoyl)phenyl]pyridine-3-carboxamide Traditional Name: 2-chloro-N-[2-(3-morpholin-4-ium-4-ylpropylcarbamoyl)phenyl]nicotinamide Formula: C20H24ClN4O3+ MolecularWeight: 403.88256

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCNC(=O)C2=CC=CC=C2NC(=O)C3=C(N=CC=C3)Cl

Isomeric SMILES

C1COCC[NH+]1CCCNC(=O)C2=CC=CC=C2NC(=O)C3=C(N=CC=C3)Cl

InChI

InChI=1S/C20H23ClN4O3/c21-18-16(6-3-8-22-18)20(27)24-17-7-2-1-5-15(17)19(26)23-9-4-10-25-11-13-28-14-12-25/h1-3,5-8H,4,9-14H2,(H,23,26)(H,24,27)/p+1