[4-(cyclopropylcarbamoyl)phenyl]methyl-(furan-2-ylmethyl)-(3-phenoxypropyl)azanium

Systemtic Name: [4-(cyclopropylcarbamoyl)phenyl]methyl-(furan-2-ylmethyl)-(3-phenoxypropyl)azanium Openeye Name: [4-(cyclopropylcarbamoyl)phenyl]methyl-(2-furylmethyl)-(3-phenoxypropyl)ammonium CAS Name: [4-[(cyclopropylamino)-oxomethyl]phenyl]methyl-(2-furanylmethyl)-(3-phenoxypropyl)ammonium IUPAC Name: [4-(cyclopropylcarbamoyl)phenyl]methyl-(furan-2-ylmethyl)-(3-phenoxypropyl)azanium Traditional Name: [4-(cyclopropylcarbamoyl)benzyl]-(2-furfuryl)-(3-phenoxypropyl)ammonium Formula: C25H29N2O3+ MolecularWeight: 405.50936

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC=C(C=C2)C[NH+](CCCOC3=CC=CC=C3)CC4=CC=CO4

Isomeric SMILES

C1CC1NC(=O)C2=CC=C(C=C2)C[NH+](CCCOC3=CC=CC=C3)CC4=CC=CO4

InChI

InChI=1S/C25H28N2O3/c28-25(26-22-13-14-22)21-11-9-20(10-12-21)18-27(19-24-8-4-16-30-24)15-5-17-29-23-6-2-1-3-7-23/h1-4,6-12,16,22H,5,13-15,17-19H2,(H,26,28)/p+1