4-[3-(azepan-1-ylsulfonyl)-4-chloranyl-phenyl]carbonyl-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: 4-[3-(azepan-1-ylsulfonyl)-4-chloranyl-phenyl]carbonyl-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: 4-[3-(azepan-1-ylsulfonyl)-4-chloro-benzoyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: 4-[[3-(1-azepanylsulfonyl)-4-chlorophenyl]-oxomethyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: 4-[3-(azepan-1-ylsulfonyl)-4-chlorobenzoyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: 4-[3-(azepan-1-ylsulfonyl)-4-chloro-benzoyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C23H26ClN3O5S MolecularWeight: 491.98764

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1CN(C2=CC=CC=C2O1)C(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CNC(=O)C1CN(C2=CC=CC=C2O1)C(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C23H26ClN3O5S/c1-25-22(28)20-15-27(18-8-4-5-9-19(18)32-20)23(29)16-10-11-17(24)21(14-16)33(30,31)26-12-6-2-3-7-13-26/h4-5,8-11,14,20H,2-3,6-7,12-13,15H2,1H3,(H,25,28)