4-[3-(aminomethyl)-6-methoxy-7-(3-piperidin-1-ylpropoxy)quinolin-4-yl]piperazine-1-carboxylic acid

Systemtic Name: 4-[3-(aminomethyl)-6-methoxy-7-(3-piperidin-1-ylpropoxy)quinolin-4-yl]piperazine-1-carboxylic acid Openeye Name: 4-[3-(aminomethyl)-6-methoxy-7-[3-(1-piperidyl)propoxy]-4-quinolyl]piperazine-1-carboxylic acid CAS Name: 4-[3-(aminomethyl)-6-methoxy-7-[3-(1-piperidinyl)propoxy]-4-quinolinyl]-1-piperazinecarboxylic acid IUPAC Name: 4-[3-(aminomethyl)-6-methoxy-7-(3-piperidin-1-ylpropoxy)quinolin-4-yl]piperazine-1-carboxylic acid Traditional Name: 4-[3-(aminomethyl)-6-methoxy-7-(3-piperidinopropoxy)-4-quinolyl]piperazine-1-carboxylic acid Formula: C24H35N5O4 MolecularWeight: 457.5658

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=C(C=N2)CN)N3CCN(CC3)C(=O)O)OCCCN4CCCCC4

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=C(C=N2)CN)N3CCN(CC3)C(=O)O)OCCCN4CCCCC4

InChI

InChI=1S/C24H35N5O4/c1-32-21-14-19-20(15-22(21)33-13-5-8-27-6-3-2-4-7-27)26-17-18(16-25)23(19)28-9-11-29(12-10-28)24(30)31/h14-15,17H,2-13,16,25H2,1H3,(H,30,31)