ethyl 1-[(6-chloranyl-1,3-benzodioxol-5-yl)methyl]-5-oxidanyl-indole-2-carboxylate

Systemtic Name: ethyl 1-[(6-chloranyl-1,3-benzodioxol-5-yl)methyl]-5-oxidanyl-indole-2-carboxylate Openeye Name: ethyl 1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-5-hydroxy-indole-2-carboxylate CAS Name: 1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-5-hydroxy-2-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-5-hydroxyindole-2-carboxylate Traditional Name: 1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-5-hydroxy-indole-2-carboxylic acid ethyl ester Formula: C19H16ClNO5 MolecularWeight: 373.78704

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(N1CC3=CC4=C(C=C3Cl)OCO4)C=CC(=C2)O

Isomeric SMILES

CCOC(=O)C1=CC2=C(N1CC3=CC4=C(C=C3Cl)OCO4)C=CC(=C2)O

InChI

InChI=1S/C19H16ClNO5/c1-2-24-19(23)16-6-11-5-13(22)3-4-15(11)21(16)9-12-7-17-18(8-14(12)20)26-10-25-17/h3-8,22H,2,9-10H2,1H3