4-(3-chloranylpyridin-2-yl)-N-(4-ethoxyphenyl)-2,3-dihydro-1,4-benzoxazine-8-carboxamide

Systemtic Name: 4-(3-chloranylpyridin-2-yl)-N-(4-ethoxyphenyl)-2,3-dihydro-1,4-benzoxazine-8-carboxamide Openeye Name: 4-(3-chloro-2-pyridyl)-N-(4-ethoxyphenyl)-2,3-dihydro-1,4-benzoxazine-8-carboxamide CAS Name: 4-(3-chloro-2-pyridinyl)-N-(4-ethoxyphenyl)-2,3-dihydro-1,4-benzoxazine-8-carboxamide IUPAC Name: 4-(3-chloropyridin-2-yl)-N-(4-ethoxyphenyl)-2,3-dihydro-1,4-benzoxazine-8-carboxamide Traditional Name: 4-(3-chloro-2-pyridyl)-N-p-phenetyl-2,3-dihydro-1,4-benzoxazine-8-carboxamide Formula: C22H20ClN3O3 MolecularWeight: 409.8655

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C2=C3C(=CC=C2)N(CCO3)C4=C(C=CC=N4)Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C2=C3C(=CC=C2)N(CCO3)C4=C(C=CC=N4)Cl

InChI

InChI=1S/C22H20ClN3O3/c1-2-28-16-10-8-15(9-11-16)25-22(27)17-5-3-7-19-20(17)29-14-13-26(19)21-18(23)6-4-12-24-21/h3-12H,2,13-14H2,1H3,(H,25,27)