4-[4-(5-chloranyl-1,3-benzoxazol-2-yl)piperidin-1-yl]-3-nitro-N-propan-2-yl-benzenesulfonamide

Systemtic Name: 4-[4-(5-chloranyl-1,3-benzoxazol-2-yl)piperidin-1-yl]-3-nitro-N-propan-2-yl-benzenesulfonamide Openeye Name: 4-[4-(5-chloro-1,3-benzoxazol-2-yl)-1-piperidyl]-N-isopropyl-3-nitro-benzenesulfonamide CAS Name: 4-[4-(5-chloro-1,3-benzoxazol-2-yl)-1-piperidinyl]-3-nitro-N-propan-2-ylbenzenesulfonamide IUPAC Name: 4-[4-(5-chloro-1,3-benzoxazol-2-yl)piperidin-1-yl]-3-nitro-N-propan-2-ylbenzenesulfonamide Traditional Name: 4-[4-(5-chloro-1,3-benzoxazol-2-yl)piperidino]-N-isopropyl-3-nitro-benzenesulfonamide Formula: C21H23ClN4O5S MolecularWeight: 478.94912

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NS(=O)(=O)C1=CC(=C(C=C1)N2CCC(CC2)C3=NC4=C(O3)C=CC(=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C)NS(=O)(=O)C1=CC(=C(C=C1)N2CCC(CC2)C3=NC4=C(O3)C=CC(=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H23ClN4O5S/c1-13(2)24-32(29,30)16-4-5-18(19(12-16)26(27)28)25-9-7-14(8-10-25)21-23-17-11-15(22)3-6-20(17)31-21/h3-6,11-14,24H,7-10H2,1-2H3