4-(phenylmethyl)sulfonyl-N-(3-propan-2-yloxypropyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: 4-(phenylmethyl)sulfonyl-N-(3-propan-2-yloxypropyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: 4-benzylsulfonyl-N-(3-isopropoxypropyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: 4-(phenylmethyl)sulfonyl-N-(3-propan-2-yloxypropyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: 4-benzylsulfonyl-N-(3-propan-2-yloxypropyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: 4-benzylsulfonyl-N-(3-isopropoxypropyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C22H28N2O5S MolecularWeight: 432.53312

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCCNC(=O)C1CN(C2=CC=CC=C2O1)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

CC(C)OCCCNC(=O)C1CN(C2=CC=CC=C2O1)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C22H28N2O5S/c1-17(2)28-14-8-13-23-22(25)21-15-24(19-11-6-7-12-20(19)29-21)30(26,27)16-18-9-4-3-5-10-18/h3-7,9-12,17,21H,8,13-16H2,1-2H3,(H,23,25)