(Z)-but-2-enedioic acid; 7-(ethoxymethoxy)-8-methyl-4-piperazin-1-yl-chromen-2-one

Systemtic Name: (Z)-but-2-enedioic acid; 7-(ethoxymethoxy)-8-methyl-4-piperazin-1-yl-chromen-2-one Openeye Name: 7-(ethoxymethoxy)-8-methyl-4-piperazin-1-yl-chromen-2-one; maleic acid CAS Name: (Z)-2-butenedioic acid; 7-(ethoxymethoxy)-8-methyl-4-(1-piperazinyl)-1-benzopyran-2-one IUPAC Name: (Z)-but-2-enedioic acid; 7-(ethoxymethoxy)-8-methyl-4-piperazin-1-ylchromen-2-one Traditional Name: 7-(ethoxymethoxy)-8-methyl-4-piperazino-coumarin; maleic acid Formula: C21H26N2O8 MolecularWeight: 434.43974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOCOC1=C(C2=C(C=C1)C(=CC(=O)O2)N3CCNCC3)C.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CCOCOC1=C(C2=C(C=C1)C(=CC(=O)O2)N3CCNCC3)C.C(=C\C(=O)O)\C(=O)O

InChI

InChI=1S/C17H22N2O4.C4H4O4/c1-3-21-11-22-15-5-4-13-14(19-8-6-18-7-9-19)10-16(20)23-17(13)12(15)2;5-3(6)1-2-4(7)8/h4-5,10,18H,3,6-9,11H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1-