ethyl 5-oxidanyl-3-[(4-phenylpiperazin-1-yl)methyl]-1H-indole-2-carboxylate

Systemtic Name: ethyl 5-oxidanyl-3-[(4-phenylpiperazin-1-yl)methyl]-1H-indole-2-carboxylate Openeye Name: ethyl 5-hydroxy-3-[(4-phenylpiperazin-1-yl)methyl]-1H-indole-2-carboxylate CAS Name: 5-hydroxy-3-[(4-phenyl-1-piperazinyl)methyl]-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-hydroxy-3-[(4-phenylpiperazin-1-yl)methyl]-1H-indole-2-carboxylate Traditional Name: 5-hydroxy-3-[(4-phenylpiperazino)methyl]-1H-indole-2-carboxylic acid ethyl ester Formula: C22H25N3O3 MolecularWeight: 379.4522

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)O)CN3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)O)CN3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C22H25N3O3/c1-2-28-22(27)21-19(18-14-17(26)8-9-20(18)23-21)15-24-10-12-25(13-11-24)16-6-4-3-5-7-16/h3-9,14,23,26H,2,10-13,15H2,1H3