ethyl 1-[[1-(4-nitrophenyl)indol-3-yl]methyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[[1-(4-nitrophenyl)indol-3-yl]methyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[[1-(4-nitrophenyl)indol-3-yl]methyl]piperidine-4-carboxylate CAS Name: 1-[[1-(4-nitrophenyl)-3-indolyl]methyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[[1-(4-nitrophenyl)indol-3-yl]methyl]piperidine-4-carboxylate Traditional Name: 1-[[1-(4-nitrophenyl)indol-3-yl]methyl]isonipecotic acid ethyl ester Formula: C23H25N3O4 MolecularWeight: 407.4623

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)CC2=CN(C3=CC=CC=C32)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1CCN(CC1)CC2=CN(C3=CC=CC=C32)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H25N3O4/c1-2-30-23(27)17-11-13-24(14-12-17)15-18-16-25(22-6-4-3-5-21(18)22)19-7-9-20(10-8-19)26(28)29/h3-10,16-17H,2,11-15H2,1H3