2-chloranyl-N-[2-(3,4-dimethylphenyl)-2,3-dihydro-1,3-benzoxazol-5-yl]pyridine-3-carboxamide

Systemtic Name: 2-chloranyl-N-[2-(3,4-dimethylphenyl)-2,3-dihydro-1,3-benzoxazol-5-yl]pyridine-3-carboxamide Openeye Name: 2-chloro-N-[2-(3,4-dimethylphenyl)-2,3-dihydro-1,3-benzoxazol-5-yl]pyridine-3-carboxamide CAS Name: 2-chloro-N-[2-(3,4-dimethylphenyl)-2,3-dihydro-1,3-benzoxazol-5-yl]-3-pyridinecarboxamide IUPAC Name: 2-chloro-N-[2-(3,4-dimethylphenyl)-2,3-dihydro-1,3-benzoxazol-5-yl]pyridine-3-carboxamide Traditional Name: 2-chloro-N-[2-(3,4-dimethylphenyl)-2,3-dihydro-1,3-benzoxazol-5-yl]nicotinamide Formula: C21H18ClN3O2 MolecularWeight: 379.83952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2NC3=C(O2)C=CC(=C3)NC(=O)C4=C(N=CC=C4)Cl)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2NC3=C(O2)C=CC(=C3)NC(=O)C4=C(N=CC=C4)Cl)C

InChI

InChI=1S/C21H18ClN3O2/c1-12-5-6-14(10-13(12)2)21-25-17-11-15(7-8-18(17)27-21)24-20(26)16-4-3-9-23-19(16)22/h3-11,21,25H,1-2H3,(H,24,26)