furan-2-ylmethyl-[(3-methoxycarbonyl-4-methyl-quinolin-2-yl)methyl]-(thiophen-2-ylmethyl)azanium

Systemtic Name: furan-2-ylmethyl-[(3-methoxycarbonyl-4-methyl-quinolin-2-yl)methyl]-(thiophen-2-ylmethyl)azanium Openeye Name: 2-furylmethyl-[(3-methoxycarbonyl-4-methyl-2-quinolyl)methyl]-(2-thienylmethyl)ammonium CAS Name: 2-furanylmethyl-[(3-methoxycarbonyl-4-methyl-2-quinolinyl)methyl]-(thiophen-2-ylmethyl)ammonium IUPAC Name: furan-2-ylmethyl-[(3-methoxycarbonyl-4-methylquinolin-2-yl)methyl]-(thiophen-2-ylmethyl)azanium Traditional Name: (3-carbomethoxy-4-methyl-2-quinolyl)methyl-(2-furfuryl)-(2-thenyl)ammonium Formula: C23H23N2O3S+ MolecularWeight: 407.50532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)C[NH+](CC3=CC=CO3)CC4=CC=CS4)C(=O)OC

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)C[NH+](CC3=CC=CO3)CC4=CC=CS4)C(=O)OC

InChI

InChI=1S/C23H22N2O3S/c1-16-19-9-3-4-10-20(19)24-21(22(16)23(26)27-2)15-25(13-17-7-5-11-28-17)14-18-8-6-12-29-18/h3-12H,13-15H2,1-2H3/p+1