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

Systemtic Name: N-(4-bromophenyl)-4-[3-cyano-6-methoxy-7-(3-pyrrolidin-1-ylpropoxy)quinolin-4-yl]piperazine-1-carboxamide Openeye Name: N-(4-bromophenyl)-4-[3-cyano-6-methoxy-7-(3-pyrrolidin-1-ylpropoxy)-4-quinolyl]piperazine-1-carboxamide CAS Name: N-(4-bromophenyl)-4-[3-cyano-6-methoxy-7-[3-(1-pyrrolidinyl)propoxy]-4-quinolinyl]-1-piperazinecarboxamide IUPAC Name: N-(4-bromophenyl)-4-[3-cyano-6-methoxy-7-(3-pyrrolidin-1-ylpropoxy)quinolin-4-yl]piperazine-1-carboxamide Traditional Name: N-(4-bromophenyl)-4-[3-cyano-6-methoxy-7-(3-pyrrolidinopropoxy)-4-quinolyl]piperazine-1-carboxamide Formula: C29H33BrN6O3 MolecularWeight: 593.51472

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H33BrN6O3/c1-38-26-17-24-25(18-27(26)39-16-4-11-34-9-2-3-10-34)32-20-21(19-31)28(24)35-12-14-36(15-13-35)29(37)33-23-7-5-22(30)6-8-23/h5-8,17-18,20H,2-4,9-16H2,1H3,(H,33,37)