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

Systemtic Name: (3-methoxycarbonyl-4-methyl-quinolin-2-yl)methyl-methyl-[[4-(methylcarbamoyl)phenyl]methyl]azanium Openeye Name: (3-methoxycarbonyl-4-methyl-2-quinolyl)methyl-methyl-[[4-(methylcarbamoyl)phenyl]methyl]ammonium CAS Name: (3-methoxycarbonyl-4-methyl-2-quinolinyl)methyl-methyl-[[4-(methylcarbamoyl)phenyl]methyl]ammonium IUPAC Name: (3-methoxycarbonyl-4-methylquinolin-2-yl)methyl-methyl-[[4-(methylcarbamoyl)phenyl]methyl]azanium Traditional Name: (3-carbomethoxy-4-methyl-2-quinolyl)methyl-methyl-[4-(methylcarbamoyl)benzyl]ammonium Formula: C23H26N3O3+ MolecularWeight: 392.47084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)C[NH+](C)CC3=CC=C(C=C3)C(=O)NC)C(=O)OC

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)C[NH+](C)CC3=CC=C(C=C3)C(=O)NC)C(=O)OC

InChI

InChI=1S/C23H25N3O3/c1-15-18-7-5-6-8-19(18)25-20(21(15)23(28)29-4)14-26(3)13-16-9-11-17(12-10-16)22(27)24-2/h5-12H,13-14H2,1-4H3,(H,24,27)/p+1