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

Systemtic Name: ethyl 4-[3-(cyclohexylamino)-2-oxidanyl-propoxy]-1,3-dimethyl-indole-2-carboxylate Openeye Name: ethyl 4-[3-(cyclohexylamino)-2-hydroxy-propoxy]-1,3-dimethyl-indole-2-carboxylate CAS Name: 4-[3-(cyclohexylamino)-2-hydroxypropoxy]-1,3-dimethyl-2-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-(cyclohexylamino)-2-hydroxypropoxy]-1,3-dimethylindole-2-carboxylate Traditional Name: 4-[3-(cyclohexylamino)-2-hydroxy-propoxy]-1,3-dimethyl-indole-2-carboxylic acid ethyl ester Formula: C22H32N2O4 MolecularWeight: 388.50048

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N1C)C=CC=C2OCC(CNC3CCCCC3)O)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N1C)C=CC=C2OCC(CNC3CCCCC3)O)C

InChI

InChI=1S/C22H32N2O4/c1-4-27-22(26)21-15(2)20-18(24(21)3)11-8-12-19(20)28-14-17(25)13-23-16-9-6-5-7-10-16/h8,11-12,16-17,23,25H,4-7,9-10,13-14H2,1-3H3