(3-methoxycarbonyl-4-methyl-quinolin-2-yl)methyl-[(1S)-2-methyl-1-phenyl-propyl]azanium

Systemtic Name: (3-methoxycarbonyl-4-methyl-quinolin-2-yl)methyl-[(1S)-2-methyl-1-phenyl-propyl]azanium Openeye Name: (3-methoxycarbonyl-4-methyl-2-quinolyl)methyl-[(1S)-2-methyl-1-phenyl-propyl]ammonium CAS Name: (3-methoxycarbonyl-4-methyl-2-quinolinyl)methyl-[(1S)-2-methyl-1-phenylpropyl]ammonium IUPAC Name: (3-methoxycarbonyl-4-methylquinolin-2-yl)methyl-[(1S)-2-methyl-1-phenylpropyl]azanium Traditional Name: (3-carbomethoxy-4-methyl-2-quinolyl)methyl-[(1S)-2-methyl-1-phenyl-propyl]ammonium Formula: C23H27N2O2+ MolecularWeight: 363.47268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)C[NH2+]C(C3=CC=CC=C3)C(C)C)C(=O)OC

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)C[NH2+][C@H](C3=CC=CC=C3)C(C)C)C(=O)OC

InChI

InChI=1S/C23H26N2O2/c1-15(2)22(17-10-6-5-7-11-17)24-14-20-21(23(26)27-4)16(3)18-12-8-9-13-19(18)25-20/h5-13,15,22,24H,14H2,1-4H3/p+1/t22-/m0/s1