ethyl 5-[3-(4-nitrophenyl)carbonyl-4-propan-2-yl-pyrrol-1-yl]pentanoate

Systemtic Name: ethyl 5-[3-(4-nitrophenyl)carbonyl-4-propan-2-yl-pyrrol-1-yl]pentanoate Openeye Name: ethyl 5-[3-isopropyl-4-(4-nitrobenzoyl)pyrrol-1-yl]pentanoate CAS Name: 5-[3-[(4-nitrophenyl)-oxomethyl]-4-propan-2-yl-1-pyrrolyl]pentanoic acid ethyl ester IUPAC Name: ethyl 5-[3-(4-nitrobenzoyl)-4-propan-2-ylpyrrol-1-yl]pentanoate Traditional Name: 5-[3-isopropyl-4-(4-nitrobenzoyl)pyrrol-1-yl]valeric acid ethyl ester Formula: C21H26N2O5 MolecularWeight: 386.44154

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCN1C=C(C(=C1)C(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(C)C

Isomeric SMILES

CCOC(=O)CCCCN1C=C(C(=C1)C(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(C)C

InChI

InChI=1S/C21H26N2O5/c1-4-28-20(24)7-5-6-12-22-13-18(15(2)3)19(14-22)21(25)16-8-10-17(11-9-16)23(26)27/h8-11,13-15H,4-7,12H2,1-3H3