4-chloranyl-N-(3,3-dimethyl-6-nitro-2-oxidanylidene-1-propyl-indol-5-yl)benzamide

Systemtic Name: 4-chloranyl-N-(3,3-dimethyl-6-nitro-2-oxidanylidene-1-propyl-indol-5-yl)benzamide Openeye Name: 4-chloro-N-(3,3-dimethyl-6-nitro-2-oxo-1-propyl-indolin-5-yl)benzamide CAS Name: 4-chloro-N-(3,3-dimethyl-6-nitro-2-oxo-1-propyl-5-indolyl)benzamide IUPAC Name: 4-chloro-N-(3,3-dimethyl-6-nitro-2-oxo-1-propylindol-5-yl)benzamide Traditional Name: 4-chloro-N-(2-keto-3,3-dimethyl-6-nitro-1-propyl-indolin-5-yl)benzamide Formula: C20H20ClN3O4 MolecularWeight: 401.8435

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC(=C(C=C2C(C1=O)(C)C)NC(=O)C3=CC=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CCCN1C2=CC(=C(C=C2C(C1=O)(C)C)NC(=O)C3=CC=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H20ClN3O4/c1-4-9-23-16-11-17(24(27)28)15(10-14(16)20(2,3)19(23)26)22-18(25)12-5-7-13(21)8-6-12/h5-8,10-11H,4,9H2,1-3H3,(H,22,25)