ethyl 1,2-dimethyl-5-(2-oxidanyl-3-phenylazanyl-propoxy)indole-3-carboxylate

Systemtic Name: ethyl 1,2-dimethyl-5-(2-oxidanyl-3-phenylazanyl-propoxy)indole-3-carboxylate Openeye Name: ethyl 5-(3-anilino-2-hydroxy-propoxy)-1,2-dimethyl-indole-3-carboxylate CAS Name: 5-(3-anilino-2-hydroxypropoxy)-1,2-dimethyl-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(3-anilino-2-hydroxypropoxy)-1,2-dimethylindole-3-carboxylate Traditional Name: 5-(3-anilino-2-hydroxy-propoxy)-1,2-dimethyl-indole-3-carboxylic acid ethyl ester Formula: C22H26N2O4 MolecularWeight: 382.45284

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OCC(CNC3=CC=CC=C3)O)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OCC(CNC3=CC=CC=C3)O)C)C

InChI

InChI=1S/C22H26N2O4/c1-4-27-22(26)21-15(2)24(3)20-11-10-18(12-19(20)21)28-14-17(25)13-23-16-8-6-5-7-9-16/h5-12,17,23,25H,4,13-14H2,1-3H3