6-(4-acetamidophenoxy)-5-methyl-1-(naphthalen-1-ylmethyl)-4-oxidanylidene-quinoline-3-carboxylic acid; N-methyl-1-phenyl-methanamine

Systemtic Name: 6-(4-acetamidophenoxy)-5-methyl-1-(naphthalen-1-ylmethyl)-4-oxidanylidene-quinoline-3-carboxylic acid; N-methyl-1-phenyl-methanamine Openeye Name: 6-(4-acetamidophenoxy)-5-methyl-1-(1-naphthylmethyl)-4-oxo-quinoline-3-carboxylic acid; N-methyl-1-phenyl-methanamine CAS Name: 6-(4-acetamidophenoxy)-5-methyl-1-(1-naphthalenylmethyl)-4-oxo-3-quinolinecarboxylic acid; N-methyl-1-phenylmethanamine IUPAC Name: 6-(4-acetamidophenoxy)-5-methyl-1-(naphthalen-1-ylmethyl)-4-oxoquinoline-3-carboxylic acid; N-methyl-1-phenylmethanamine Traditional Name: 6-(4-acetamidophenoxy)-4-keto-5-methyl-1-(1-naphthylmethyl)quinoline-3-carboxylic acid; benzyl(methyl)amine Formula: C38H35N3O5 MolecularWeight: 613.7016

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1C(=O)C(=CN2CC3=CC=CC4=CC=CC=C43)C(=O)O)OC5=CC=C(C=C5)NC(=O)C.CNCC1=CC=CC=C1

Isomeric SMILES

CC1=C(C=CC2=C1C(=O)C(=CN2CC3=CC=CC4=CC=CC=C43)C(=O)O)OC5=CC=C(C=C5)NC(=O)C.CNCC1=CC=CC=C1

InChI

InChI=1S/C30H24N2O5.C8H11N/c1-18-27(37-23-12-10-22(11-13-23)31-19(2)33)15-14-26-28(18)29(34)25(30(35)36)17-32(26)16-21-8-5-7-20-6-3-4-9-24(20)21;1-9-7-8-5-3-2-4-6-8/h3-15,17H,16H2,1-2H3,(H,31,33)(H,35,36);2-6,9H,7H2,1H3