[4-[(4-propan-2-ylphenyl)methyl]piperazin-4-ium-1-yl]-quinolin-2-yl-methanone

Systemtic Name: [4-[(4-propan-2-ylphenyl)methyl]piperazin-4-ium-1-yl]-quinolin-2-yl-methanone Openeye Name: [4-[(4-isopropylphenyl)methyl]piperazin-4-ium-1-yl]-(2-quinolyl)methanone CAS Name: [4-[(4-propan-2-ylphenyl)methyl]-1-piperazin-4-iumyl]-(2-quinolinyl)methanone IUPAC Name: [4-[(4-propan-2-ylphenyl)methyl]piperazin-4-ium-1-yl]-quinolin-2-ylmethanone Traditional Name: [4-(4-isopropylbenzyl)piperazin-4-ium-1-yl]-(2-quinolyl)methanone Formula: C24H28N3O+ MolecularWeight: 374.49862

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C[NH+]2CCN(CC2)C(=O)C3=NC4=CC=CC=C4C=C3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C[NH+]2CCN(CC2)C(=O)C3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C24H27N3O/c1-18(2)20-9-7-19(8-10-20)17-26-13-15-27(16-14-26)24(28)23-12-11-21-5-3-4-6-22(21)25-23/h3-12,18H,13-17H2,1-2H3/p+1