3-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]-1-methyl-indole-2-carboxylate

Systemtic Name: 3-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]-1-methyl-indole-2-carboxylate Openeye Name: 3-[2-(1,3-benzodioxol-5-ylamino)-2-oxo-ethyl]-1-methyl-indole-2-carboxylate CAS Name: 3-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]-1-methyl-2-indolecarboxylate IUPAC Name: 3-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]-1-methylindole-2-carboxylate Traditional Name: 3-[2-(1,3-benzodioxol-5-ylamino)-2-keto-ethyl]-1-methyl-indole-2-carboxylate Formula: C19H15N2O5- MolecularWeight: 351.3328

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=C1C(=O)[O-])CC(=O)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CN1C2=CC=CC=C2C(=C1C(=O)[O-])CC(=O)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H16N2O5/c1-21-14-5-3-2-4-12(14)13(18(21)19(23)24)9-17(22)20-11-6-7-15-16(8-11)26-10-25-15/h2-8H,9-10H2,1H3,(H,20,22)(H,23,24)/p-1