ethyl 1,2-dimethyl-5-[2-oxidanyl-3-(1-oxidanylbutan-2-ylamino)propoxy]indole-3-carboxylate

Systemtic Name: ethyl 1,2-dimethyl-5-[2-oxidanyl-3-(1-oxidanylbutan-2-ylamino)propoxy]indole-3-carboxylate Openeye Name: ethyl 5-[2-hydroxy-3-[1-(hydroxymethyl)propylamino]propoxy]-1,2-dimethyl-indole-3-carboxylate CAS Name: 5-[2-hydroxy-3-(1-hydroxybutan-2-ylamino)propoxy]-1,2-dimethyl-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-hydroxy-3-(1-hydroxybutan-2-ylamino)propoxy]-1,2-dimethylindole-3-carboxylate Traditional Name: 5-[2-hydroxy-3-(1-methylolpropylamino)propoxy]-1,2-dimethyl-indole-3-carboxylic acid ethyl ester Formula: C20H30N2O5 MolecularWeight: 378.4626

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NCC(COC1=CC2=C(C=C1)N(C(=C2C(=O)OCC)C)C)O

Isomeric SMILES

CCC(CO)NCC(COC1=CC2=C(C=C1)N(C(=C2C(=O)OCC)C)C)O

InChI

InChI=1S/C20H30N2O5/c1-5-14(11-23)21-10-15(24)12-27-16-7-8-18-17(9-16)19(13(3)22(18)4)20(25)26-6-2/h7-9,14-15,21,23-24H,5-6,10-12H2,1-4H3