4-bromanyl-N-cyclopropyl-N-[[4-(cyclopropylcarbamoyl)phenyl]methyl]-3-nitro-benzamide

Systemtic Name: 4-bromanyl-N-cyclopropyl-N-[[4-(cyclopropylcarbamoyl)phenyl]methyl]-3-nitro-benzamide Openeye Name: 4-bromo-N-cyclopropyl-N-[[4-(cyclopropylcarbamoyl)phenyl]methyl]-3-nitro-benzamide CAS Name: 4-bromo-N-cyclopropyl-N-[[4-[(cyclopropylamino)-oxomethyl]phenyl]methyl]-3-nitrobenzamide IUPAC Name: 4-bromo-N-cyclopropyl-N-[[4-(cyclopropylcarbamoyl)phenyl]methyl]-3-nitrobenzamide Traditional Name: 4-bromo-N-cyclopropyl-N-[4-(cyclopropylcarbamoyl)benzyl]-3-nitro-benzamide Formula: C21H20BrN3O4 MolecularWeight: 458.3052

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC=C(C=C2)CN(C3CC3)C(=O)C4=CC(=C(C=C4)Br)[N+](=O)[O-]

Isomeric SMILES

C1CC1NC(=O)C2=CC=C(C=C2)CN(C3CC3)C(=O)C4=CC(=C(C=C4)Br)[N+](=O)[O-]

InChI

InChI=1S/C21H20BrN3O4/c22-18-10-5-15(11-19(18)25(28)29)21(27)24(17-8-9-17)12-13-1-3-14(4-2-13)20(26)23-16-6-7-16/h1-5,10-11,16-17H,6-9,12H2,(H,23,26)