(Z)-2-[5-(1-methylpyrrolidin-2-yl)-1-pent-1-ynyl-2H-pyridin-3-yl]but-2-enedioate

Systemtic Name: (Z)-2-[5-(1-methylpyrrolidin-2-yl)-1-pent-1-ynyl-2H-pyridin-3-yl]but-2-enedioate Openeye Name: (Z)-2-[5-(1-methylpyrrolidin-2-yl)-1-pent-1-ynyl-2H-pyridin-3-yl]but-2-enedioate CAS Name: (Z)-2-[5-(1-methyl-2-pyrrolidinyl)-1-pent-1-ynyl-2H-pyridin-3-yl]-2-butenedioate IUPAC Name: (Z)-2-[5-(1-methylpyrrolidin-2-yl)-1-pent-1-ynyl-2H-pyridin-3-yl]but-2-enedioate Traditional Name: (Z)-2-[5-(1-methylpyrrolidin-2-yl)-1-pent-1-ynyl-2H-pyridin-3-yl]but-2-enedioate Formula: C19H22N2O4-2 MolecularWeight: 342.38898

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Descriptors Computed from Structure

Canonical SMILES:

CCCC#CN1CC(=CC(=C1)C2CCCN2C)C(=CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

CCCC#CN1CC(=CC(=C1)C2CCCN2C)/C(=C/C(=O)[O-])/C(=O)[O-]

InChI

InChI=1S/C19H24N2O4/c1-3-4-5-9-21-12-14(16(19(24)25)11-18(22)23)10-15(13-21)17-7-6-8-20(17)2/h10-11,13,17H,3-4,6-8,12H2,1-2H3,(H,22,23)(H,24,25)/p-2/b16-11-