cycloheptyl-[[5-(4-methoxycarbonylphenyl)furan-2-yl]methyl]azanium

Systemtic Name: cycloheptyl-[[5-(4-methoxycarbonylphenyl)furan-2-yl]methyl]azanium Openeye Name: cycloheptyl-[[5-(4-methoxycarbonylphenyl)-2-furyl]methyl]ammonium CAS Name: cycloheptyl-[[5-(4-methoxycarbonylphenyl)-2-furanyl]methyl]ammonium IUPAC Name: cycloheptyl-[[5-(4-methoxycarbonylphenyl)furan-2-yl]methyl]azanium Traditional Name: [5-(4-carbomethoxyphenyl)-2-furyl]methyl-cycloheptyl-ammonium Formula: C20H26NO3+ MolecularWeight: 328.42534

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C[NH2+]C3CCCCCC3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C[NH2+]C3CCCCCC3

InChI

InChI=1S/C20H25NO3/c1-23-20(22)16-10-8-15(9-11-16)19-13-12-18(24-19)14-21-17-6-4-2-3-5-7-17/h8-13,17,21H,2-7,14H2,1H3/p+1