[2-(4-ethoxycarbonylpiperazin-1-yl)-6-methyl-quinolin-3-yl]methyl-(2-methylpropyl)azanium

Systemtic Name: [2-(4-ethoxycarbonylpiperazin-1-yl)-6-methyl-quinolin-3-yl]methyl-(2-methylpropyl)azanium Openeye Name: [2-(4-ethoxycarbonylpiperazin-1-yl)-6-methyl-3-quinolyl]methyl-isobutyl-ammonium CAS Name: [2-(4-ethoxycarbonyl-1-piperazinyl)-6-methyl-3-quinolinyl]methyl-(2-methylpropyl)ammonium IUPAC Name: [2-(4-ethoxycarbonylpiperazin-1-yl)-6-methylquinolin-3-yl]methyl-(2-methylpropyl)azanium Traditional Name: [2-(4-carbethoxypiperazino)-6-methyl-3-quinolyl]methyl-isobutyl-ammonium Formula: C22H33N4O2+ MolecularWeight: 385.52302

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=C(C=C3C=C(C=CC3=N2)C)C[NH2+]CC(C)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=C(C=C3C=C(C=CC3=N2)C)C[NH2+]CC(C)C

InChI

InChI=1S/C22H32N4O2/c1-5-28-22(27)26-10-8-25(9-11-26)21-19(15-23-14-16(2)3)13-18-12-17(4)6-7-20(18)24-21/h6-7,12-13,16,23H,5,8-11,14-15H2,1-4H3/p+1