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

Systemtic Name: (Z)-but-2-enedioic acid; 8-methyl-4-piperazin-1-yl-7-(2-pyrrolidin-1-ylethoxy)chromen-2-one Openeye Name: maleic acid; 8-methyl-4-piperazin-1-yl-7-(2-pyrrolidin-1-ylethoxy)chromen-2-one CAS Name: (Z)-2-butenedioic acid; 8-methyl-4-(1-piperazinyl)-7-[2-(1-pyrrolidinyl)ethoxy]-1-benzopyran-2-one IUPAC Name: (Z)-but-2-enedioic acid; 8-methyl-4-piperazin-1-yl-7-(2-pyrrolidin-1-ylethoxy)chromen-2-one Traditional Name: maleic acid; 8-methyl-4-piperazino-7-(2-pyrrolidinoethoxy)coumarin Formula: C24H31N3O7 MolecularWeight: 473.51884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C=C2N3CCNCC3)OCCN4CCCC4.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C=C2N3CCNCC3)OCCN4CCCC4.C(=C\C(=O)O)\C(=O)O

InChI

InChI=1S/C20H27N3O3.C4H4O4/c1-15-18(25-13-12-22-8-2-3-9-22)5-4-16-17(14-19(24)26-20(15)16)23-10-6-21-7-11-23;5-3(6)1-2-4(7)8/h4-5,14,21H,2-3,6-13H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1-