N-[(4-tert-butylphenyl)methyl]-4-(3-chloranylpyridin-2-yl)-2,3-dihydro-1,4-benzoxazine-8-carboxamide

Systemtic Name: N-[(4-tert-butylphenyl)methyl]-4-(3-chloranylpyridin-2-yl)-2,3-dihydro-1,4-benzoxazine-8-carboxamide Openeye Name: N-[(4-tert-butylphenyl)methyl]-4-(3-chloro-2-pyridyl)-2,3-dihydro-1,4-benzoxazine-8-carboxamide CAS Name: N-[(4-tert-butylphenyl)methyl]-4-(3-chloro-2-pyridinyl)-2,3-dihydro-1,4-benzoxazine-8-carboxamide IUPAC Name: N-[(4-tert-butylphenyl)methyl]-4-(3-chloropyridin-2-yl)-2,3-dihydro-1,4-benzoxazine-8-carboxamide Traditional Name: N-(4-tert-butylbenzyl)-4-(3-chloro-2-pyridyl)-2,3-dihydro-1,4-benzoxazine-8-carboxamide Formula: C25H26ClN3O2 MolecularWeight: 435.94584

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H26ClN3O2/c1-25(2,3)18-11-9-17(10-12-18)16-28-24(30)19-6-4-8-21-22(19)31-15-14-29(21)23-20(26)7-5-13-27-23/h4-13H,14-16H2,1-3H3,(H,28,30)