N-[3-(cyclopropylcarbamoyl)phenyl]-4-morpholin-4-yl-pyridin-1-ium-2-carboxamide

Systemtic Name: N-[3-(cyclopropylcarbamoyl)phenyl]-4-morpholin-4-yl-pyridin-1-ium-2-carboxamide Openeye Name: N-[3-(cyclopropylcarbamoyl)phenyl]-4-morpholino-pyridin-1-ium-2-carboxamide CAS Name: N-[3-[(cyclopropylamino)-oxomethyl]phenyl]-4-(4-morpholinyl)-2-pyridin-1-iumcarboxamide IUPAC Name: N-[3-(cyclopropylcarbamoyl)phenyl]-4-morpholin-4-ylpyridin-1-ium-2-carboxamide Traditional Name: N-[3-(cyclopropylcarbamoyl)phenyl]-4-morpholino-pyridin-1-ium-2-carboxamide Formula: C20H23N4O3+ MolecularWeight: 367.42162

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC(=CC=C2)NC(=O)C3=[NH+]C=CC(=C3)N4CCOCC4

Isomeric SMILES

C1CC1NC(=O)C2=CC(=CC=C2)NC(=O)C3=[NH+]C=CC(=C3)N4CCOCC4

InChI

InChI=1S/C20H22N4O3/c25-19(22-15-4-5-15)14-2-1-3-16(12-14)23-20(26)18-13-17(6-7-21-18)24-8-10-27-11-9-24/h1-3,6-7,12-13,15H,4-5,8-11H2,(H,22,25)(H,23,26)/p+1