methyl 2-[4-[(3-butyl-4-oxidanylidene-7-pyrrolidin-1-ylcarbonyl-quinolin-1-yl)methyl]phenyl]benzoate

Systemtic Name: methyl 2-[4-[(3-butyl-4-oxidanylidene-7-pyrrolidin-1-ylcarbonyl-quinolin-1-yl)methyl]phenyl]benzoate Openeye Name: methyl 2-[4-[[3-butyl-4-oxo-7-(pyrrolidine-1-carbonyl)-1-quinolyl]methyl]phenyl]benzoate CAS Name: 2-[4-[[3-butyl-4-oxo-7-[oxo(1-pyrrolidinyl)methyl]-1-quinolinyl]methyl]phenyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-[[3-butyl-4-oxo-7-(pyrrolidine-1-carbonyl)quinolin-1-yl]methyl]phenyl]benzoate Traditional Name: 2-[4-[[3-butyl-4-keto-7-(pyrrolidine-1-carbonyl)-1-quinolyl]methyl]phenyl]benzoic acid methyl ester Formula: C33H34N2O4 MolecularWeight: 522.63406

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CN(C2=C(C1=O)C=CC(=C2)C(=O)N3CCCC3)CC4=CC=C(C=C4)C5=CC=CC=C5C(=O)OC

Isomeric SMILES

CCCCC1=CN(C2=C(C1=O)C=CC(=C2)C(=O)N3CCCC3)CC4=CC=C(C=C4)C5=CC=CC=C5C(=O)OC

InChI

InChI=1S/C33H34N2O4/c1-3-4-9-26-22-35(30-20-25(16-17-29(30)31(26)36)32(37)34-18-7-8-19-34)21-23-12-14-24(15-13-23)27-10-5-6-11-28(27)33(38)39-2/h5-6,10-17,20,22H,3-4,7-9,18-19,21H2,1-2H3