(Z)-but-2-enedioate; 2-piperazin-1-ylquinoline

Systemtic Name: (Z)-but-2-enedioate; 2-piperazin-1-ylquinoline Openeye Name: (Z)-but-2-enedioate; 2-piperazin-1-ylquinoline CAS Name: (Z)-2-butenedioate; 2-(1-piperazinyl)quinoline IUPAC Name: (Z)-but-2-enedioate; 2-piperazin-1-ylquinoline Traditional Name: 2-piperazinoquinoline maleate Formula: C17H17N3O4-2 MolecularWeight: 327.33458

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=NC3=CC=CC=C3C=C2.C(=CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1CN(CCN1)C2=NC3=CC=CC=C3C=C2.C(=C\C(=O)[O-])\C(=O)[O-]

InChI

InChI=1S/C13H15N3.C4H4O4/c1-2-4-12-11(3-1)5-6-13(15-12)16-9-7-14-8-10-16;5-3(6)1-2-4(7)8/h1-6,14H,7-10H2;1-2H,(H,5,6)(H,7,8)/p-2/b;2-1-