(Z)-2-[2-(6-chloranylindol-1-yl)-1-(dimethylamino)ethyl]but-2-enedioate

Systemtic Name: (Z)-2-[2-(6-chloranylindol-1-yl)-1-(dimethylamino)ethyl]but-2-enedioate Openeye Name: (Z)-2-[2-(6-chloroindol-1-yl)-1-(dimethylamino)ethyl]but-2-enedioate CAS Name: (Z)-2-[2-(6-chloro-1-indolyl)-1-(dimethylamino)ethyl]-2-butenedioate IUPAC Name: (Z)-2-[2-(6-chloroindol-1-yl)-1-(dimethylamino)ethyl]but-2-enedioate Traditional Name: (Z)-2-[2-(6-chloroindol-1-yl)-1-(dimethylamino)ethyl]but-2-enedioate Formula: C16H15ClN2O4-2 MolecularWeight: 334.7543

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CN1C=CC2=C1C=C(C=C2)Cl)C(=CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

CN(C)C(CN1C=CC2=C1C=C(C=C2)Cl)/C(=C/C(=O)[O-])/C(=O)[O-]

InChI

InChI=1S/C16H17ClN2O4/c1-18(2)14(12(16(22)23)8-15(20)21)9-19-6-5-10-3-4-11(17)7-13(10)19/h3-8,14H,9H2,1-2H3,(H,20,21)(H,22,23)/p-2/b12-8-