(2S)-2-[2-[4-(3,4-dichlorophenyl)piperazin-1-ium-1-yl]ethyl]-4H-pyrido[3,2-b][1,4]oxazin-3-one

Systemtic Name: (2S)-2-[2-[4-(3,4-dichlorophenyl)piperazin-1-ium-1-yl]ethyl]-4H-pyrido[3,2-b][1,4]oxazin-3-one Openeye Name: (2S)-2-[2-[4-(3,4-dichlorophenyl)piperazin-1-ium-1-yl]ethyl]-4H-pyrido[3,2-b][1,4]oxazin-3-one CAS Name: (2S)-2-[2-[4-(3,4-dichlorophenyl)-1-piperazin-1-iumyl]ethyl]-4H-pyrido[3,2-b][1,4]oxazin-3-one IUPAC Name: (2S)-2-[2-[4-(3,4-dichlorophenyl)piperazin-1-ium-1-yl]ethyl]-4H-pyrido[3,2-b][1,4]oxazin-3-one Traditional Name: (2S)-2-[2-[4-(3,4-dichlorophenyl)piperazin-1-ium-1-yl]ethyl]-4H-pyrido[3,2-b][1,4]oxazin-3-one Formula: C19H21Cl2N4O2+ MolecularWeight: 408.30164

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCC2C(=O)NC3=C(O2)C=CC=N3)C4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

C1CN(CC[NH+]1CC[C@H]2C(=O)NC3=C(O2)C=CC=N3)C4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C19H20Cl2N4O2/c20-14-4-3-13(12-15(14)21)25-10-8-24(9-11-25)7-5-17-19(26)23-18-16(27-17)2-1-6-22-18/h1-4,6,12,17H,5,7-11H2,(H,22,23,26)/p+1/t17-/m0/s1