3-(4-cyclohexylpiperazin-4-ium-1-yl)carbonyl-6-ethoxy-1H-quinolin-4-one

Systemtic Name: 3-(4-cyclohexylpiperazin-4-ium-1-yl)carbonyl-6-ethoxy-1H-quinolin-4-one Openeye Name: 3-(4-cyclohexylpiperazin-4-ium-1-carbonyl)-6-ethoxy-1H-quinolin-4-one CAS Name: 3-[(4-cyclohexyl-1-piperazin-4-iumyl)-oxomethyl]-6-ethoxy-1H-quinolin-4-one IUPAC Name: 3-(4-cyclohexylpiperazin-4-ium-1-carbonyl)-6-ethoxy-1H-quinolin-4-one Traditional Name: 3-(4-cyclohexylpiperazin-4-ium-1-carbonyl)-6-ethoxy-4-quinolone Formula: C22H30N3O3+ MolecularWeight: 384.4919

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)NC=C(C2=O)C(=O)N3CC[NH+](CC3)C4CCCCC4

Isomeric SMILES

CCOC1=CC2=C(C=C1)NC=C(C2=O)C(=O)N3CC[NH+](CC3)C4CCCCC4

InChI

InChI=1S/C22H29N3O3/c1-2-28-17-8-9-20-18(14-17)21(26)19(15-23-20)22(27)25-12-10-24(11-13-25)16-6-4-3-5-7-16/h8-9,14-16H,2-7,10-13H2,1H3,(H,23,26)/p+1