3-(4-ethylpiperazin-4-ium-1-yl)carbonyl-8-methoxy-chromen-2-one

Systemtic Name: 3-(4-ethylpiperazin-4-ium-1-yl)carbonyl-8-methoxy-chromen-2-one Openeye Name: 3-(4-ethylpiperazin-4-ium-1-carbonyl)-8-methoxy-chromen-2-one CAS Name: 3-[(4-ethyl-1-piperazin-4-iumyl)-oxomethyl]-8-methoxy-1-benzopyran-2-one IUPAC Name: 3-(4-ethylpiperazin-4-ium-1-carbonyl)-8-methoxychromen-2-one Traditional Name: 3-(4-ethylpiperazin-4-ium-1-carbonyl)-8-methoxy-coumarin Formula: C17H21N2O4+ MolecularWeight: 317.35964

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)C2=CC3=C(C(=CC=C3)OC)OC2=O

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)C2=CC3=C(C(=CC=C3)OC)OC2=O

InChI

InChI=1S/C17H20N2O4/c1-3-18-7-9-19(10-8-18)16(20)13-11-12-5-4-6-14(22-2)15(12)23-17(13)21/h4-6,11H,3,7-10H2,1-2H3/p+1