[2-(4-ethylphenyl)-6-methyl-quinolin-4-yl]-(4-phenylpiperazin-1-yl)methanone

Systemtic Name: [2-(4-ethylphenyl)-6-methyl-quinolin-4-yl]-(4-phenylpiperazin-1-yl)methanone Openeye Name: [2-(4-ethylphenyl)-6-methyl-4-quinolyl]-(4-phenylpiperazin-1-yl)methanone CAS Name: [2-(4-ethylphenyl)-6-methyl-4-quinolinyl]-(4-phenyl-1-piperazinyl)methanone IUPAC Name: [2-(4-ethylphenyl)-6-methylquinolin-4-yl]-(4-phenylpiperazin-1-yl)methanone Traditional Name: [2-(4-ethylphenyl)-6-methyl-4-quinolyl]-(4-phenylpiperazino)methanone Formula: C29H29N3O MolecularWeight: 435.56006

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)C)C(=C2)C(=O)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)C)C(=C2)C(=O)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C29H29N3O/c1-3-22-10-12-23(13-11-22)28-20-26(25-19-21(2)9-14-27(25)30-28)29(33)32-17-15-31(16-18-32)24-7-5-4-6-8-24/h4-14,19-20H,3,15-18H2,1-2H3