ethyl 5-[3-(3-nitrophenyl)carbonylindol-1-yl]pentanoate

Systemtic Name: ethyl 5-[3-(3-nitrophenyl)carbonylindol-1-yl]pentanoate Openeye Name: ethyl 5-[3-(3-nitrobenzoyl)indol-1-yl]pentanoate CAS Name: 5-[3-[(3-nitrophenyl)-oxomethyl]-1-indolyl]pentanoic acid ethyl ester IUPAC Name: ethyl 5-[3-(3-nitrobenzoyl)indol-1-yl]pentanoate Traditional Name: 5-[3-(3-nitrobenzoyl)indol-1-yl]valeric acid ethyl ester Formula: C22H22N2O5 MolecularWeight: 394.42048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCN1C=C(C2=CC=CC=C21)C(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CCCCN1C=C(C2=CC=CC=C21)C(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H22N2O5/c1-2-29-21(25)12-5-6-13-23-15-19(18-10-3-4-11-20(18)23)22(26)16-8-7-9-17(14-16)24(27)28/h3-4,7-11,14-15H,2,5-6,12-13H2,1H3