(3-ethyl-2-methyl-quinolin-6-yl)-(4-methoxycyclohexyl)methanone; methanesulfonic acid

Systemtic Name: (3-ethyl-2-methyl-quinolin-6-yl)-(4-methoxycyclohexyl)methanone; methanesulfonic acid Openeye Name: (3-ethyl-2-methyl-6-quinolyl)-(4-methoxycyclohexyl)methanone; methanesulfonic acid CAS Name: (3-ethyl-2-methyl-6-quinolinyl)-(4-methoxycyclohexyl)methanone; methanesulfonic acid IUPAC Name: (3-ethyl-2-methylquinolin-6-yl)-(4-methoxycyclohexyl)methanone; methanesulfonic acid Traditional Name: (3-ethyl-2-methyl-6-quinolyl)-(4-methoxycyclohexyl)methanone; mesylic acid Formula: C21H29NO5S MolecularWeight: 407.52366

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C2C=CC(=CC2=C1)C(=O)C3CCC(CC3)OC)C.CS(=O)(=O)O

Isomeric SMILES

CCC1=C(N=C2C=CC(=CC2=C1)C(=O)C3CCC(CC3)OC)C.CS(=O)(=O)O

InChI

InChI=1S/C20H25NO2.CH4O3S/c1-4-14-11-17-12-16(7-10-19(17)21-13(14)2)20(22)15-5-8-18(23-3)9-6-15;1-5(2,3)4/h7,10-12,15,18H,4-6,8-9H2,1-3H3;1H3,(H,2,3,4)