methyl-[(2-methyl-4-oxidanylidene-6-propoxycarbonyl-1H-quinolin-3-yl)methyl]-(phenylmethyl)azanium

Systemtic Name: methyl-[(2-methyl-4-oxidanylidene-6-propoxycarbonyl-1H-quinolin-3-yl)methyl]-(phenylmethyl)azanium Openeye Name: benzyl-methyl-[(2-methyl-4-oxo-6-propoxycarbonyl-1H-quinolin-3-yl)methyl]ammonium CAS Name: methyl-[[2-methyl-4-oxo-6-[oxo(propoxy)methyl]-1H-quinolin-3-yl]methyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-methyl-[(2-methyl-4-oxo-6-propoxycarbonyl-1H-quinolin-3-yl)methyl]azanium Traditional Name: benzyl-[(4-keto-2-methyl-6-propoxycarbonyl-1H-quinolin-3-yl)methyl]-methyl-ammonium Formula: C23H27N2O3+ MolecularWeight: 379.47208

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC2=C(C=C1)NC(=C(C2=O)C[NH+](C)CC3=CC=CC=C3)C

Isomeric SMILES

CCCOC(=O)C1=CC2=C(C=C1)NC(=C(C2=O)C[NH+](C)CC3=CC=CC=C3)C

InChI

InChI=1S/C23H26N2O3/c1-4-12-28-23(27)18-10-11-21-19(13-18)22(26)20(16(2)24-21)15-25(3)14-17-8-6-5-7-9-17/h5-11,13H,4,12,14-15H2,1-3H3,(H,24,26)/p+1