ethyl 2-(diethylaminomethyl)-4-(dimethylaminomethyl)-5-oxidanyl-1-phenyl-indole-3-carboxylate

Systemtic Name: ethyl 2-(diethylaminomethyl)-4-(dimethylaminomethyl)-5-oxidanyl-1-phenyl-indole-3-carboxylate Openeye Name: ethyl 2-(diethylaminomethyl)-4-(dimethylaminomethyl)-5-hydroxy-1-phenyl-indole-3-carboxylate CAS Name: 2-(diethylaminomethyl)-4-(dimethylaminomethyl)-5-hydroxy-1-phenyl-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(diethylaminomethyl)-4-(dimethylaminomethyl)-5-hydroxy-1-phenylindole-3-carboxylate Traditional Name: 2-(diethylaminomethyl)-4-(dimethylaminomethyl)-5-hydroxy-1-phenyl-indole-3-carboxylic acid ethyl ester Formula: C25H33N3O3 MolecularWeight: 423.54782

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=C(C2=C(N1C3=CC=CC=C3)C=CC(=C2CN(C)C)O)C(=O)OCC

Isomeric SMILES

CCN(CC)CC1=C(C2=C(N1C3=CC=CC=C3)C=CC(=C2CN(C)C)O)C(=O)OCC

InChI

InChI=1S/C25H33N3O3/c1-6-27(7-2)17-21-24(25(30)31-8-3)23-19(16-26(4)5)22(29)15-14-20(23)28(21)18-12-10-9-11-13-18/h9-15,29H,6-8,16-17H2,1-5H3