2-[(3-nitro-2,4,5-triphenyl-pyrrol-1-yl)methoxy]ethyl ethanoate

Systemtic Name: 2-[(3-nitro-2,4,5-triphenyl-pyrrol-1-yl)methoxy]ethyl ethanoate Openeye Name: 2-[(3-nitro-2,4,5-triphenyl-pyrrol-1-yl)methoxy]ethyl acetate CAS Name: acetic acid 2-[(3-nitro-2,4,5-triphenyl-1-pyrrolyl)methoxy]ethyl ester IUPAC Name: 2-[(3-nitro-2,4,5-triphenylpyrrol-1-yl)methoxy]ethyl acetate Traditional Name: acetic acid 2-[(3-nitro-2,4,5-triphenyl-pyrrol-1-yl)methoxy]ethyl ester Formula: C27H24N2O5 MolecularWeight: 456.48986

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCOCN1C(=C(C(=C1C2=CC=CC=C2)[N+](=O)[O-])C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(=O)OCCOCN1C(=C(C(=C1C2=CC=CC=C2)[N+](=O)[O-])C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H24N2O5/c1-20(30)34-18-17-33-19-28-25(22-13-7-3-8-14-22)24(21-11-5-2-6-12-21)27(29(31)32)26(28)23-15-9-4-10-16-23/h2-16H,17-19H2,1H3