1-adamantyl-[[5-(4-ethoxycarbonylphenyl)furan-2-yl]methyl]azanium

Systemtic Name: 1-adamantyl-[[5-(4-ethoxycarbonylphenyl)furan-2-yl]methyl]azanium Openeye Name: 1-adamantyl-[[5-(4-ethoxycarbonylphenyl)-2-furyl]methyl]ammonium CAS Name: 1-adamantyl-[[5-(4-ethoxycarbonylphenyl)-2-furanyl]methyl]ammonium IUPAC Name: 1-adamantyl-[[5-(4-ethoxycarbonylphenyl)furan-2-yl]methyl]azanium Traditional Name: 1-adamantyl-[[5-(4-carbethoxyphenyl)-2-furyl]methyl]ammonium Formula: C24H30NO3+ MolecularWeight: 380.4999

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C[NH2+]C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C[NH2+]C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C24H29NO3/c1-2-27-23(26)20-5-3-19(4-6-20)22-8-7-21(28-22)15-25-24-12-16-9-17(13-24)11-18(10-16)14-24/h3-8,16-18,25H,2,9-15H2,1H3/p+1