N-[3-(4-tert-butylphenyl)carbonylphenyl]-4-(phenylsulfonyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: N-[3-(4-tert-butylphenyl)carbonylphenyl]-4-(phenylsulfonyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: 4-(benzenesulfonyl)-N-[3-(4-tert-butylbenzoyl)phenyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: 4-(benzenesulfonyl)-N-[3-[(4-tert-butylphenyl)-oxomethyl]phenyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: 4-(benzenesulfonyl)-N-[3-(4-tert-butylbenzoyl)phenyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: 4-besyl-N-[3-(4-tert-butylbenzoyl)phenyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C32H30N2O5S MolecularWeight: 554.656

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)C2=CC(=CC=C2)NC(=O)C3CN(C4=CC=CC=C4O3)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)C2=CC(=CC=C2)NC(=O)C3CN(C4=CC=CC=C4O3)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C32H30N2O5S/c1-32(2,3)24-18-16-22(17-19-24)30(35)23-10-9-11-25(20-23)33-31(36)29-21-34(27-14-7-8-15-28(27)39-29)40(37,38)26-12-5-4-6-13-26/h4-20,29H,21H2,1-3H3,(H,33,36)