6-chloranyl-3-[(3S)-3-(4-methylpiperazin-4-ium-1-yl)carbonylpiperidin-1-yl]-4-phenyl-1H-quinolin-2-one

Systemtic Name: 6-chloranyl-3-[(3S)-3-(4-methylpiperazin-4-ium-1-yl)carbonylpiperidin-1-yl]-4-phenyl-1H-quinolin-2-one Openeye Name: 6-chloro-3-[(3S)-3-(4-methylpiperazin-4-ium-1-carbonyl)-1-piperidyl]-4-phenyl-1H-quinolin-2-one CAS Name: 6-chloro-3-[(3S)-3-[(4-methyl-1-piperazin-4-iumyl)-oxomethyl]-1-piperidinyl]-4-phenyl-1H-quinolin-2-one IUPAC Name: 6-chloro-3-[(3S)-3-(4-methylpiperazin-4-ium-1-carbonyl)piperidin-1-yl]-4-phenyl-1H-quinolin-2-one Traditional Name: 6-chloro-3-[(3S)-3-(4-methylpiperazin-4-ium-1-carbonyl)piperidino]-4-phenyl-carbostyril Formula: C26H30ClN4O2+ MolecularWeight: 465.995

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)C2CCCN(C2)C3=C(C4=C(C=CC(=C4)Cl)NC3=O)C5=CC=CC=C5

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)[C@H]2CCCN(C2)C3=C(C4=C(C=CC(=C4)Cl)NC3=O)C5=CC=CC=C5

InChI

InChI=1S/C26H29ClN4O2/c1-29-12-14-30(15-13-29)26(33)19-8-5-11-31(17-19)24-23(18-6-3-2-4-7-18)21-16-20(27)9-10-22(21)28-25(24)32/h2-4,6-7,9-10,16,19H,5,8,11-15,17H2,1H3,(H,28,32)/p+1/t19-/m0/s1