6-chloranyl-3-[(3R)-3-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]carbonylpiperidin-1-yl]-4-phenyl-1H-quinolin-2-one

Systemtic Name: 6-chloranyl-3-[(3R)-3-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]carbonylpiperidin-1-yl]-4-phenyl-1H-quinolin-2-one Openeye Name: 6-chloro-3-[(3R)-3-[4-(2-hydroxyethyl)piperazin-4-ium-1-carbonyl]-1-piperidyl]-4-phenyl-1H-quinolin-2-one CAS Name: 6-chloro-3-[(3R)-3-[[4-(2-hydroxyethyl)-1-piperazin-4-iumyl]-oxomethyl]-1-piperidinyl]-4-phenyl-1H-quinolin-2-one IUPAC Name: 6-chloro-3-[(3R)-3-[4-(2-hydroxyethyl)piperazin-4-ium-1-carbonyl]piperidin-1-yl]-4-phenyl-1H-quinolin-2-one Traditional Name: 6-chloro-3-[(3R)-3-[4-(2-hydroxyethyl)piperazin-4-ium-1-carbonyl]piperidino]-4-phenyl-carbostyril Formula: C27H32ClN4O3+ MolecularWeight: 496.02098

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=C(C3=C(C=CC(=C3)Cl)NC2=O)C4=CC=CC=C4)C(=O)N5CC[NH+](CC5)CCO

Isomeric SMILES

C1C[C@H](CN(C1)C2=C(C3=C(C=CC(=C3)Cl)NC2=O)C4=CC=CC=C4)C(=O)N5CC[NH+](CC5)CCO

InChI

InChI=1S/C27H31ClN4O3/c28-21-8-9-23-22(17-21)24(19-5-2-1-3-6-19)25(26(34)29-23)32-10-4-7-20(18-32)27(35)31-13-11-30(12-14-31)15-16-33/h1-3,5-6,8-9,17,20,33H,4,7,10-16,18H2,(H,29,34)/p+1/t20-/m1/s1