ethyl 7-tert-butyl-3-(3-nitrophenyl)carbonyl-indolizine-1-carboxylate

Systemtic Name: ethyl 7-tert-butyl-3-(3-nitrophenyl)carbonyl-indolizine-1-carboxylate Openeye Name: ethyl 7-tert-butyl-3-(3-nitrobenzoyl)indolizine-1-carboxylate CAS Name: 7-tert-butyl-3-[(3-nitrophenyl)-oxomethyl]-1-indolizinecarboxylic acid ethyl ester IUPAC Name: ethyl 7-tert-butyl-3-(3-nitrobenzoyl)indolizine-1-carboxylate Traditional Name: 7-tert-butyl-3-(3-nitrobenzoyl)indolizine-1-carboxylic acid ethyl ester Formula: C22H22N2O5 MolecularWeight: 394.42048

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C=C(C=CN2C(=C1)C(=O)C3=CC(=CC=C3)[N+](=O)[O-])C(C)(C)C

Isomeric SMILES

CCOC(=O)C1=C2C=C(C=CN2C(=C1)C(=O)C3=CC(=CC=C3)[N+](=O)[O-])C(C)(C)C

InChI

InChI=1S/C22H22N2O5/c1-5-29-21(26)17-13-19(20(25)14-7-6-8-16(11-14)24(27)28)23-10-9-15(12-18(17)23)22(2,3)4/h6-13H,5H2,1-4H3