3-(azepan-1-ylsulfonyl)-4-bromanyl-N-(3-nitrophenyl)benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-bromanyl-N-(3-nitrophenyl)benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-bromo-N-(3-nitrophenyl)benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-bromo-N-(3-nitrophenyl)benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-bromo-N-(3-nitrophenyl)benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-bromo-N-(3-nitrophenyl)benzamide Formula: C19H20BrN3O5S MolecularWeight: 482.3482

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-])Br

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-])Br

InChI

InChI=1S/C19H20BrN3O5S/c20-17-9-8-14(19(24)21-15-6-5-7-16(13-15)23(25)26)12-18(17)29(27,28)22-10-3-1-2-4-11-22/h5-9,12-13H,1-4,10-11H2,(H,21,24)