(2-methylpyrrolidin-1-yl)-[2-[4-(phenylmethyl)piperazin-1-yl]quinolin-4-yl]methanone

Systemtic Name: (2-methylpyrrolidin-1-yl)-[2-[4-(phenylmethyl)piperazin-1-yl]quinolin-4-yl]methanone Openeye Name: [2-(4-benzylpiperazin-1-yl)-4-quinolyl]-(2-methylpyrrolidin-1-yl)methanone CAS Name: (2-methyl-1-pyrrolidinyl)-[2-[4-(phenylmethyl)-1-piperazinyl]-4-quinolinyl]methanone IUPAC Name: [2-(4-benzylpiperazin-1-yl)quinolin-4-yl]-(2-methylpyrrolidin-1-yl)methanone Traditional Name: [2-(4-benzylpiperazino)-4-quinolyl]-(2-methylpyrrolidino)methanone Formula: C26H30N4O MolecularWeight: 414.5426

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN1C(=O)C2=CC(=NC3=CC=CC=C32)N4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

CC1CCCN1C(=O)C2=CC(=NC3=CC=CC=C32)N4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C26H30N4O/c1-20-8-7-13-30(20)26(31)23-18-25(27-24-12-6-5-11-22(23)24)29-16-14-28(15-17-29)19-21-9-3-2-4-10-21/h2-6,9-12,18,20H,7-8,13-17,19H2,1H3