N-[1-(4-methoxyphenyl)propyl]-4-(phenylsulfonyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: N-[1-(4-methoxyphenyl)propyl]-4-(phenylsulfonyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: 4-(benzenesulfonyl)-N-[1-(4-methoxyphenyl)propyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: 4-(benzenesulfonyl)-N-[1-(4-methoxyphenyl)propyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: 4-(benzenesulfonyl)-N-[1-(4-methoxyphenyl)propyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: 4-besyl-N-[1-(4-methoxyphenyl)propyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C25H26N2O5S MolecularWeight: 466.54934

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)OC)NC(=O)C2CN(C3=CC=CC=C3O2)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CCC(C1=CC=C(C=C1)OC)NC(=O)C2CN(C3=CC=CC=C3O2)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H26N2O5S/c1-3-21(18-13-15-19(31-2)16-14-18)26-25(28)24-17-27(22-11-7-8-12-23(22)32-24)33(29,30)20-9-5-4-6-10-20/h4-16,21,24H,3,17H2,1-2H3,(H,26,28)