2-[4-[3-(hydroxymethyl)-6-methoxy-7-(3-piperidin-3-ylpropoxy)quinolin-4-yl]piperazin-1-yl]-4-propan-2-yloxy-benzamide

Systemtic Name: 2-[4-[3-(hydroxymethyl)-6-methoxy-7-(3-piperidin-3-ylpropoxy)quinolin-4-yl]piperazin-1-yl]-4-propan-2-yloxy-benzamide Openeye Name: 2-[4-[3-(hydroxymethyl)-6-methoxy-7-[3-(3-piperidyl)propoxy]-4-quinolyl]piperazin-1-yl]-4-isopropoxy-benzamide CAS Name: 2-[4-[3-(hydroxymethyl)-6-methoxy-7-[3-(3-piperidinyl)propoxy]-4-quinolinyl]-1-piperazinyl]-4-propan-2-yloxybenzamide IUPAC Name: 2-[4-[3-(hydroxymethyl)-6-methoxy-7-(3-piperidin-3-ylpropoxy)quinolin-4-yl]piperazin-1-yl]-4-propan-2-yloxybenzamide Traditional Name: 4-isopropoxy-2-[4-[6-methoxy-3-methylol-7-[3-(3-piperidyl)propoxy]-4-quinolyl]piperazino]benzamide Formula: C33H45N5O5 MolecularWeight: 591.7409

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC(=C(C=C1)C(=O)N)N2CCN(CC2)C3=C(C=NC4=CC(=C(C=C43)OC)OCCCC5CCCNC5)CO

Isomeric SMILES

CC(C)OC1=CC(=C(C=C1)C(=O)N)N2CCN(CC2)C3=C(C=NC4=CC(=C(C=C43)OC)OCCCC5CCCNC5)CO

InChI

InChI=1S/C33H45N5O5/c1-22(2)43-25-8-9-26(33(34)40)29(16-25)37-11-13-38(14-12-37)32-24(21-39)20-36-28-18-31(30(41-3)17-27(28)32)42-15-5-7-23-6-4-10-35-19-23/h8-9,16-18,20,22-23,35,39H,4-7,10-15,19,21H2,1-3H3,(H2,34,40)