4-[(4-chloranyl-3-nitro-phenyl)sulfonylamino]-N-[2-[(3-methoxyphenyl)carbonylamino]ethyl]-2-oxidanyl-benzamide

Systemtic Name: 4-[(4-chloranyl-3-nitro-phenyl)sulfonylamino]-N-[2-[(3-methoxyphenyl)carbonylamino]ethyl]-2-oxidanyl-benzamide Openeye Name: 4-[(4-chloro-3-nitro-phenyl)sulfonylamino]-2-hydroxy-N-[2-[(3-methoxybenzoyl)amino]ethyl]benzamide CAS Name: 4-[(4-chloro-3-nitrophenyl)sulfonylamino]-2-hydroxy-N-[2-[[(3-methoxyphenyl)-oxomethyl]amino]ethyl]benzamide IUPAC Name: 4-[(4-chloro-3-nitrophenyl)sulfonylamino]-2-hydroxy-N-[2-[(3-methoxybenzoyl)amino]ethyl]benzamide Traditional Name: 4-[(4-chloro-3-nitro-phenyl)sulfonylamino]-2-hydroxy-N-[2-(m-anisoylamino)ethyl]benzamide Formula: C23H21ClN4O8S MolecularWeight: 548.95284

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)NCCNC(=O)C2=C(C=C(C=C2)NS(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])O

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)NCCNC(=O)C2=C(C=C(C=C2)NS(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])O

InChI

InChI=1S/C23H21ClN4O8S/c1-36-16-4-2-3-14(11-16)22(30)25-9-10-26-23(31)18-7-5-15(12-21(18)29)27-37(34,35)17-6-8-19(24)20(13-17)28(32)33/h2-8,11-13,27,29H,9-10H2,1H3,(H,25,30)(H,26,31)