N-[5-(3-butan-2-ylphenyl)carbonyl-2-nitro-phenyl]cyclobutanesulfonamide

Systemtic Name: N-[5-(3-butan-2-ylphenyl)carbonyl-2-nitro-phenyl]cyclobutanesulfonamide Openeye Name: N-[2-nitro-5-(3-sec-butylbenzoyl)phenyl]cyclobutanesulfonamide CAS Name: N-[5-[(3-butan-2-ylphenyl)-oxomethyl]-2-nitrophenyl]cyclobutanesulfonamide IUPAC Name: N-[5-(3-butan-2-ylbenzoyl)-2-nitrophenyl]cyclobutanesulfonamide Traditional Name: N-[2-nitro-5-(3-sec-butylbenzoyl)phenyl]cyclobutanesulfonamide Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC(=C1)C(=O)C2=CC(=C(C=C2)[N+](=O)[O-])NS(=O)(=O)C3CCC3

Isomeric SMILES

CCC(C)C1=CC=CC(=C1)C(=O)C2=CC(=C(C=C2)[N+](=O)[O-])NS(=O)(=O)C3CCC3

InChI

InChI=1S/C21H24N2O5S/c1-3-14(2)15-6-4-7-16(12-15)21(24)17-10-11-20(23(25)26)19(13-17)22-29(27,28)18-8-5-9-18/h4,6-7,10-14,18,22H,3,5,8-9H2,1-2H3