cyclopropanamine; 2-(4-methoxyphenyl)-3-methyl-quinoline-4-carboxylic acid

Systemtic Name: cyclopropanamine; 2-(4-methoxyphenyl)-3-methyl-quinoline-4-carboxylic acid Openeye Name: cyclopropanamine; 2-(4-methoxyphenyl)-3-methyl-quinoline-4-carboxylic acid CAS Name: cyclopropanamine; 2-(4-methoxyphenyl)-3-methyl-4-quinolinecarboxylic acid IUPAC Name: cyclopropanamine; 2-(4-methoxyphenyl)-3-methylquinoline-4-carboxylic acid Traditional Name: cyclopropylamine; 2-(4-methoxyphenyl)-3-methyl-cinchoninic acid Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N=C1C3=CC=C(C=C3)OC)C(=O)O.C1CC1N

Isomeric SMILES

CC1=C(C2=CC=CC=C2N=C1C3=CC=C(C=C3)OC)C(=O)O.C1CC1N

InChI

InChI=1S/C18H15NO3.C3H7N/c1-11-16(18(20)21)14-5-3-4-6-15(14)19-17(11)12-7-9-13(22-2)10-8-12;4-3-1-2-3/h3-10H,1-2H3,(H,20,21);3H,1-2,4H2