(Z)-but-2-enedioic acid; (3S)-3-(3-cyclopentyloxy-4-methoxy-phenyl)-2-methyl-5-oxidanylidene-N-(pyridin-3-ylmethyl)pyrazolidine-1-carboxamide

Systemtic Name: (Z)-but-2-enedioic acid; (3S)-3-(3-cyclopentyloxy-4-methoxy-phenyl)-2-methyl-5-oxidanylidene-N-(pyridin-3-ylmethyl)pyrazolidine-1-carboxamide Openeye Name: (3S)-3-[3-(cyclopentoxy)-4-methoxy-phenyl]-2-methyl-5-oxo-N-(3-pyridylmethyl)pyrazolidine-1-carboxamide; maleic acid CAS Name: (Z)-2-butenedioic acid; (3S)-3-(3-cyclopentyloxy-4-methoxyphenyl)-2-methyl-5-oxo-N-(3-pyridinylmethyl)-1-pyrazolidinecarboxamide IUPAC Name: (Z)-but-2-enedioic acid; (3S)-3-(3-cyclopentyloxy-4-methoxyphenyl)-2-methyl-5-oxo-N-(pyridin-3-ylmethyl)pyrazolidine-1-carboxamide Traditional Name: (3S)-3-[3-(cyclopentoxy)-4-methoxy-phenyl]-5-keto-2-methyl-N-(3-pyridylmethyl)pyrazolidine-1-carboxamide; maleic acid Formula: C27H32N4O8 MolecularWeight: 540.56498

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(CC(=O)N1C(=O)NCC2=CN=CC=C2)C3=CC(=C(C=C3)OC)OC4CCCC4.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CN1[C@@H](CC(=O)N1C(=O)NCC2=CN=CC=C2)C3=CC(=C(C=C3)OC)OC4CCCC4.C(=C\C(=O)O)\C(=O)O

InChI

InChI=1S/C23H28N4O4.C4H4O4/c1-26-19(13-22(28)27(26)23(29)25-15-16-6-5-11-24-14-16)17-9-10-20(30-2)21(12-17)31-18-7-3-4-8-18;5-3(6)1-2-4(7)8/h5-6,9-12,14,18-19H,3-4,7-8,13,15H2,1-2H3,(H,25,29);1-2H,(H,5,6)(H,7,8)/b;2-1-/t19-;/m0./s1