[4-[(3-chloranyl-4-methyl-quinolin-2-yl)methyl]piperazin-4-ium-1-yl]-cyclopropyl-methanone

Systemtic Name: [4-[(3-chloranyl-4-methyl-quinolin-2-yl)methyl]piperazin-4-ium-1-yl]-cyclopropyl-methanone Openeye Name: [4-[(3-chloro-4-methyl-2-quinolyl)methyl]piperazin-4-ium-1-yl]-cyclopropyl-methanone CAS Name: [4-[(3-chloro-4-methyl-2-quinolinyl)methyl]-1-piperazin-4-iumyl]-cyclopropylmethanone IUPAC Name: [4-[(3-chloro-4-methylquinolin-2-yl)methyl]piperazin-4-ium-1-yl]-cyclopropylmethanone Traditional Name: [4-[(3-chloro-4-methyl-2-quinolyl)methyl]piperazin-4-ium-1-yl]-cyclopropyl-methanone Formula: C19H23ClN3O+ MolecularWeight: 344.85842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)C[NH+]3CCN(CC3)C(=O)C4CC4)Cl

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)C[NH+]3CCN(CC3)C(=O)C4CC4)Cl

InChI

InChI=1S/C19H22ClN3O/c1-13-15-4-2-3-5-16(15)21-17(18(13)20)12-22-8-10-23(11-9-22)19(24)14-6-7-14/h2-5,14H,6-12H2,1H3/p+1