[4-[[8-methyl-3-(pyrrolidin-1-ylmethyl)quinolin-7-yl]carbamoyl]phenyl] propanoate

Systemtic Name: [4-[[8-methyl-3-(pyrrolidin-1-ylmethyl)quinolin-7-yl]carbamoyl]phenyl] propanoate Openeye Name: [4-[[8-methyl-3-(pyrrolidin-1-ylmethyl)-7-quinolyl]carbamoyl]phenyl] propanoate CAS Name: propanoic acid [4-[[[8-methyl-3-(1-pyrrolidinylmethyl)-7-quinolinyl]amino]-oxomethyl]phenyl] ester IUPAC Name: [4-[[8-methyl-3-(pyrrolidin-1-ylmethyl)quinolin-7-yl]carbamoyl]phenyl] propanoate Traditional Name: propionic acid [4-[[8-methyl-3-(pyrrolidinomethyl)-7-quinolyl]carbamoyl]phenyl] ester Formula: C25H27N3O3 MolecularWeight: 417.50018

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1=CC=C(C=C1)C(=O)NC2=C(C3=NC=C(C=C3C=C2)CN4CCCC4)C

Isomeric SMILES

CCC(=O)OC1=CC=C(C=C1)C(=O)NC2=C(C3=NC=C(C=C3C=C2)CN4CCCC4)C

InChI

InChI=1S/C25H27N3O3/c1-3-23(29)31-21-9-6-19(7-10-21)25(30)27-22-11-8-20-14-18(15-26-24(20)17(22)2)16-28-12-4-5-13-28/h6-11,14-15H,3-5,12-13,16H2,1-2H3,(H,27,30)