N-(4-cyanophenyl)-4-[3-(hydroxymethyl)-6-methoxy-7-(3-pyrrolidin-1-ylpropoxy)quinolin-4-yl]piperazine-1-carboxamide

Systemtic Name: N-(4-cyanophenyl)-4-[3-(hydroxymethyl)-6-methoxy-7-(3-pyrrolidin-1-ylpropoxy)quinolin-4-yl]piperazine-1-carboxamide Openeye Name: N-(4-cyanophenyl)-4-[3-(hydroxymethyl)-6-methoxy-7-(3-pyrrolidin-1-ylpropoxy)-4-quinolyl]piperazine-1-carboxamide CAS Name: N-(4-cyanophenyl)-4-[3-(hydroxymethyl)-6-methoxy-7-[3-(1-pyrrolidinyl)propoxy]-4-quinolinyl]-1-piperazinecarboxamide IUPAC Name: N-(4-cyanophenyl)-4-[3-(hydroxymethyl)-6-methoxy-7-(3-pyrrolidin-1-ylpropoxy)quinolin-4-yl]piperazine-1-carboxamide Traditional Name: N-(4-cyanophenyl)-4-[6-methoxy-3-methylol-7-(3-pyrrolidinopropoxy)-4-quinolyl]piperazine-1-carboxamide Formula: C30H36N6O4 MolecularWeight: 544.64464

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=C(C=N2)CO)N3CCN(CC3)C(=O)NC4=CC=C(C=C4)C#N)OCCCN5CCCC5

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=C(C=N2)CO)N3CCN(CC3)C(=O)NC4=CC=C(C=C4)C#N)OCCCN5CCCC5

InChI

InChI=1S/C30H36N6O4/c1-39-27-17-25-26(18-28(27)40-16-4-11-34-9-2-3-10-34)32-20-23(21-37)29(25)35-12-14-36(15-13-35)30(38)33-24-7-5-22(19-31)6-8-24/h5-8,17-18,20,37H,2-4,9-16,21H2,1H3,(H,33,38)