3-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]carbonyl-1-(4-methoxyphenyl)-7,7-dimethyl-6,8-dihydroquinoline-2,5-dione

Systemtic Name: 3-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]carbonyl-1-(4-methoxyphenyl)-7,7-dimethyl-6,8-dihydroquinoline-2,5-dione Openeye Name: 3-[4-(2-hydroxyethyl)piperazin-4-ium-1-carbonyl]-1-(4-methoxyphenyl)-7,7-dimethyl-6,8-dihydroquinoline-2,5-dione CAS Name: 3-[[4-(2-hydroxyethyl)-1-piperazin-4-iumyl]-oxomethyl]-1-(4-methoxyphenyl)-7,7-dimethyl-6,8-dihydroquinoline-2,5-dione IUPAC Name: 3-[4-(2-hydroxyethyl)piperazin-4-ium-1-carbonyl]-1-(4-methoxyphenyl)-7,7-dimethyl-6,8-dihydroquinoline-2,5-dione Traditional Name: 3-[4-(2-hydroxyethyl)piperazin-4-ium-1-carbonyl]-1-(4-methoxyphenyl)-7,7-dimethyl-6,8-dihydroquinoline-2,5-quinone Formula: C25H32N3O5+ MolecularWeight: 454.53868

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C=C(C(=O)N2C3=CC=C(C=C3)OC)C(=O)N4CC[NH+](CC4)CCO)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C=C(C(=O)N2C3=CC=C(C=C3)OC)C(=O)N4CC[NH+](CC4)CCO)C(=O)C1)C

InChI

InChI=1S/C25H31N3O5/c1-25(2)15-21-19(22(30)16-25)14-20(23(31)27-10-8-26(9-11-27)12-13-29)24(32)28(21)17-4-6-18(33-3)7-5-17/h4-7,14,29H,8-13,15-16H2,1-3H3/p+1