ethyl 4-[3-(1H-indol-3-yl)-3-(3-nitrophenyl)propanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[3-(1H-indol-3-yl)-3-(3-nitrophenyl)propanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[3-(1H-indol-3-yl)-3-(3-nitrophenyl)propanoyl]piperazine-1-carboxylate CAS Name: 4-[3-(1H-indol-3-yl)-3-(3-nitrophenyl)-1-oxopropyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-(1H-indol-3-yl)-3-(3-nitrophenyl)propanoyl]piperazine-1-carboxylate Traditional Name: 4-[3-(1H-indol-3-yl)-3-(3-nitrophenyl)propanoyl]piperazine-1-carboxylic acid ethyl ester Formula: C24H26N4O5 MolecularWeight: 450.48704

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)CC(C2=CC(=CC=C2)[N+](=O)[O-])C3=CNC4=CC=CC=C43

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)CC(C2=CC(=CC=C2)[N+](=O)[O-])C3=CNC4=CC=CC=C43

InChI

InChI=1S/C24H26N4O5/c1-2-33-24(30)27-12-10-26(11-13-27)23(29)15-20(17-6-5-7-18(14-17)28(31)32)21-16-25-22-9-4-3-8-19(21)22/h3-9,14,16,20,25H,2,10-13,15H2,1H3