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(Z)-but-2-enedioic acid; 4-[3-(1H-imidazol-5-yl)propoxy]benzaldehyde
(Z)-but-2-enedioic acid; 4-[3-(1H-imidazol-5-yl)propoxy]benzaldehyde
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Descriptors Computed from Structure
Canonical SMILES:
C1=CC(=CC=C1C=O)OCCCC2=CN=CN2.C(=CC(=O)O)C(=O)O
Isomeric SMILES
C1=CC(=CC=C1C=O)OCCCC2=CN=CN2.C(=C\C(=O)O)\C(=O)O
InChI
InChI=1S/C13H14N2O2.C4H4O4/c16-9-11-3-5-13(6-4-11)17-7-1-2-12-8-14-10-15-12;5-3(6)1-2-4(7)8/h3-6,8-10H,1-2,7H2,(H,14,15);1-2H,(H,5,6)(H,7,8)/b;2-1-
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