6-(azepan-1-ylsulfonyl)-3-phenacyl-1,3-benzoxazol-2-one

Systemtic Name: 6-(azepan-1-ylsulfonyl)-3-phenacyl-1,3-benzoxazol-2-one Openeye Name: 6-(azepan-1-ylsulfonyl)-3-phenacyl-1,3-benzoxazol-2-one CAS Name: 6-(1-azepanylsulfonyl)-3-phenacyl-1,3-benzoxazol-2-one IUPAC Name: 6-(azepan-1-ylsulfonyl)-3-phenacyl-1,3-benzoxazol-2-one Traditional Name: 6-(azepan-1-ylsulfonyl)-3-phenacyl-1,3-benzoxazol-2-one Formula: C21H22N2O5S MolecularWeight: 414.47478

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)O3)CC(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)O3)CC(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H22N2O5S/c24-19(16-8-4-3-5-9-16)15-23-18-11-10-17(14-20(18)28-21(23)25)29(26,27)22-12-6-1-2-7-13-22/h3-5,8-11,14H,1-2,6-7,12-13,15H2