1-adamantyl-[(3-ethoxycarbonyl-4-methyl-quinolin-2-yl)methyl]azanium

Systemtic Name: 1-adamantyl-[(3-ethoxycarbonyl-4-methyl-quinolin-2-yl)methyl]azanium Openeye Name: 1-adamantyl-[(3-ethoxycarbonyl-4-methyl-2-quinolyl)methyl]ammonium CAS Name: 1-adamantyl-[(3-ethoxycarbonyl-4-methyl-2-quinolinyl)methyl]ammonium IUPAC Name: 1-adamantyl-[(3-ethoxycarbonyl-4-methylquinolin-2-yl)methyl]azanium Traditional Name: 1-adamantyl-[(3-carbethoxy-4-methyl-2-quinolyl)methyl]ammonium Formula: C24H31N2O2+ MolecularWeight: 379.51514

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2N=C1C[NH2+]C34CC5CC(C3)CC(C5)C4)C

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2N=C1C[NH2+]C34CC5CC(C3)CC(C5)C4)C

InChI

InChI=1S/C24H30N2O2/c1-3-28-23(27)22-15(2)19-6-4-5-7-20(19)26-21(22)14-25-24-11-16-8-17(12-24)10-18(9-16)13-24/h4-7,16-18,25H,3,8-14H2,1-2H3/p+1