1-(4-methylpiperazin-1-yl)-2-[4-[1-(quinolin-3-ylmethyl)pyrrol-2-yl]carbonylphenoxy]ethanone

Systemtic Name: 1-(4-methylpiperazin-1-yl)-2-[4-[1-(quinolin-3-ylmethyl)pyrrol-2-yl]carbonylphenoxy]ethanone Openeye Name: 1-(4-methylpiperazin-1-yl)-2-[4-[1-(3-quinolylmethyl)pyrrole-2-carbonyl]phenoxy]ethanone CAS Name: 1-(4-methyl-1-piperazinyl)-2-[4-[oxo-[1-(3-quinolinylmethyl)-2-pyrrolyl]methyl]phenoxy]ethanone IUPAC Name: 1-(4-methylpiperazin-1-yl)-2-[4-[1-(quinolin-3-ylmethyl)pyrrole-2-carbonyl]phenoxy]ethanone Traditional Name: 1-(4-methylpiperazino)-2-[4-[1-(3-quinolylmethyl)pyrrole-2-carbonyl]phenoxy]ethanone Formula: C28H28N4O3 MolecularWeight: 468.54692

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)COC2=CC=C(C=C2)C(=O)C3=CC=CN3CC4=CC5=CC=CC=C5N=C4

Isomeric SMILES

CN1CCN(CC1)C(=O)COC2=CC=C(C=C2)C(=O)C3=CC=CN3CC4=CC5=CC=CC=C5N=C4

InChI

InChI=1S/C28H28N4O3/c1-30-13-15-31(16-14-30)27(33)20-35-24-10-8-22(9-11-24)28(34)26-7-4-12-32(26)19-21-17-23-5-2-3-6-25(23)29-18-21/h2-12,17-18H,13-16,19-20H2,1H3