6-chloranyl-N-[2-(cyclopentylamino)-2-oxidanylidene-ethyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)pyridine-3-carboxamide

Systemtic Name: 6-chloranyl-N-[2-(cyclopentylamino)-2-oxidanylidene-ethyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)pyridine-3-carboxamide Openeye Name: 6-chloro-N-[2-(cyclopentylamino)-2-oxo-ethyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)pyridine-3-carboxamide CAS Name: 6-chloro-N-[2-(cyclopentylamino)-2-oxoethyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-pyridinecarboxamide IUPAC Name: 6-chloro-N-[2-(cyclopentylamino)-2-oxoethyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)pyridine-3-carboxamide Traditional Name: 6-chloro-N-[2-(cyclopentylamino)-2-keto-ethyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)nicotinamide Formula: C21H22ClN3O4 MolecularWeight: 415.87008

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)CN(C2=CC3=C(C=C2)OCCO3)C(=O)C4=CN=C(C=C4)Cl

Isomeric SMILES

C1CCC(C1)NC(=O)CN(C2=CC3=C(C=C2)OCCO3)C(=O)C4=CN=C(C=C4)Cl

InChI

InChI=1S/C21H22ClN3O4/c22-19-8-5-14(12-23-19)21(27)25(13-20(26)24-15-3-1-2-4-15)16-6-7-17-18(11-16)29-10-9-28-17/h5-8,11-12,15H,1-4,9-10,13H2,(H,24,26)