[4-(cyclopropylcarbamoyl)phenyl]methyl-(furan-2-ylmethyl)-[(2-nitrophenyl)methyl]azanium

Systemtic Name: [4-(cyclopropylcarbamoyl)phenyl]methyl-(furan-2-ylmethyl)-[(2-nitrophenyl)methyl]azanium Openeye Name: [4-(cyclopropylcarbamoyl)phenyl]methyl-(2-furylmethyl)-[(2-nitrophenyl)methyl]ammonium CAS Name: [4-[(cyclopropylamino)-oxomethyl]phenyl]methyl-(2-furanylmethyl)-[(2-nitrophenyl)methyl]ammonium IUPAC Name: [4-(cyclopropylcarbamoyl)phenyl]methyl-(furan-2-ylmethyl)-[(2-nitrophenyl)methyl]azanium Traditional Name: [4-(cyclopropylcarbamoyl)benzyl]-(2-furfuryl)-(2-nitrobenzyl)ammonium Formula: C23H24N3O4+ MolecularWeight: 406.45436

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC=C(C=C2)C[NH+](CC3=CC=CC=C3[N+](=O)[O-])CC4=CC=CO4

Isomeric SMILES

C1CC1NC(=O)C2=CC=C(C=C2)C[NH+](CC3=CC=CC=C3[N+](=O)[O-])CC4=CC=CO4

InChI

InChI=1S/C23H23N3O4/c27-23(24-20-11-12-20)18-9-7-17(8-10-18)14-25(16-21-5-3-13-30-21)15-19-4-1-2-6-22(19)26(28)29/h1-10,13,20H,11-12,14-16H2,(H,24,27)/p+1