(Z)-but-2-enedioic acid; 1-[1-[(4-methyl-5-phenyl-1H-pyrazol-3-yl)oxy]ethyl]piperidine

Systemtic Name: (Z)-but-2-enedioic acid; 1-[1-[(4-methyl-5-phenyl-1H-pyrazol-3-yl)oxy]ethyl]piperidine Openeye Name: maleic acid; 1-[1-[(4-methyl-5-phenyl-1H-pyrazol-3-yl)oxy]ethyl]piperidine CAS Name: (Z)-2-butenedioic acid; 1-[1-[(4-methyl-5-phenyl-1H-pyrazol-3-yl)oxy]ethyl]piperidine IUPAC Name: (Z)-but-2-enedioic acid; 1-[1-[(4-methyl-5-phenyl-1H-pyrazol-3-yl)oxy]ethyl]piperidine Traditional Name: maleic acid; 1-[1-[(4-methyl-5-phenyl-1H-pyrazol-3-yl)oxy]ethyl]piperidine Formula: C21H27N3O5 MolecularWeight: 401.45618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NN=C1OC(C)N2CCCCC2)C3=CC=CC=C3.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CC1=C(NN=C1OC(C)N2CCCCC2)C3=CC=CC=C3.C(=C\C(=O)O)\C(=O)O

InChI

InChI=1S/C17H23N3O.C4H4O4/c1-13-16(15-9-5-3-6-10-15)18-19-17(13)21-14(2)20-11-7-4-8-12-20;5-3(6)1-2-4(7)8/h3,5-6,9-10,14H,4,7-8,11-12H2,1-2H3,(H,18,19);1-2H,(H,5,6)(H,7,8)/b;2-1-