ethyl 5-[3-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]-1H-indole-2-carboxylate

Systemtic Name: ethyl 5-[3-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]-1H-indole-2-carboxylate Openeye Name: ethyl 5-[3-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]-1H-indole-2-carboxylate CAS Name: 5-[3-[(1,3-benzodioxol-5-ylmethylamino)-oxomethyl]phenyl]-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[3-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]-1H-indole-2-carboxylate Traditional Name: 5-[3-(piperonylcarbamoyl)phenyl]-1H-indole-2-carboxylic acid ethyl ester Formula: C26H22N2O5 MolecularWeight: 442.46328

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(N1)C=CC(=C2)C3=CC(=CC=C3)C(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCOC(=O)C1=CC2=C(N1)C=CC(=C2)C3=CC(=CC=C3)C(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C26H22N2O5/c1-2-31-26(30)22-13-20-12-18(7-8-21(20)28-22)17-4-3-5-19(11-17)25(29)27-14-16-6-9-23-24(10-16)33-15-32-23/h3-13,28H,2,14-15H2,1H3,(H,27,29)