ethyl 4-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxidanyl-propoxy]-1,3-dimethyl-indole-2-carboxylate

Systemtic Name: ethyl 4-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxidanyl-propoxy]-1,3-dimethyl-indole-2-carboxylate Openeye Name: ethyl 4-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-2-hydroxy-propoxy]-1,3-dimethyl-indole-2-carboxylate CAS Name: 4-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-2-hydroxypropoxy]-1,3-dimethyl-2-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-2-hydroxypropoxy]-1,3-dimethylindole-2-carboxylate Traditional Name: 4-[3-(homoveratrylamino)-2-hydroxy-propoxy]-1,3-dimethyl-indole-2-carboxylic acid ethyl ester Formula: C26H34N2O6 MolecularWeight: 470.55796

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N1C)C=CC=C2OCC(CNCCC3=CC(=C(C=C3)OC)OC)O)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N1C)C=CC=C2OCC(CNCCC3=CC(=C(C=C3)OC)OC)O)C

InChI

InChI=1S/C26H34N2O6/c1-6-33-26(30)25-17(2)24-20(28(25)3)8-7-9-22(24)34-16-19(29)15-27-13-12-18-10-11-21(31-4)23(14-18)32-5/h7-11,14,19,27,29H,6,12-13,15-16H2,1-5H3