(3-ethoxycarbonyl-4-methyl-quinolin-2-yl)methyl-methyl-[[4-(methylcarbamoyl)phenyl]methyl]azanium

Systemtic Name: (3-ethoxycarbonyl-4-methyl-quinolin-2-yl)methyl-methyl-[[4-(methylcarbamoyl)phenyl]methyl]azanium Openeye Name: (3-ethoxycarbonyl-4-methyl-2-quinolyl)methyl-methyl-[[4-(methylcarbamoyl)phenyl]methyl]ammonium CAS Name: (3-ethoxycarbonyl-4-methyl-2-quinolinyl)methyl-methyl-[[4-(methylcarbamoyl)phenyl]methyl]ammonium IUPAC Name: (3-ethoxycarbonyl-4-methylquinolin-2-yl)methyl-methyl-[[4-(methylcarbamoyl)phenyl]methyl]azanium Traditional Name: (3-carbethoxy-4-methyl-2-quinolyl)methyl-methyl-[4-(methylcarbamoyl)benzyl]ammonium Formula: C24H28N3O3+ MolecularWeight: 406.49742

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2N=C1C[NH+](C)CC3=CC=C(C=C3)C(=O)NC)C

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2N=C1C[NH+](C)CC3=CC=C(C=C3)C(=O)NC)C

InChI

InChI=1S/C24H27N3O3/c1-5-30-24(29)22-16(2)19-8-6-7-9-20(19)26-21(22)15-27(4)14-17-10-12-18(13-11-17)23(28)25-3/h6-13H,5,14-15H2,1-4H3,(H,25,28)/p+1