2-[[2,5-dimethyl-1-[4-(5-nitropyridin-2-yl)oxyphenyl]pyrrol-3-yl]methylidene]indene-1,3-dione

Systemtic Name: 2-[[2,5-dimethyl-1-[4-(5-nitropyridin-2-yl)oxyphenyl]pyrrol-3-yl]methylidene]indene-1,3-dione Openeye Name: 2-[[2,5-dimethyl-1-[4-[(5-nitro-2-pyridyl)oxy]phenyl]pyrrol-3-yl]methylene]indane-1,3-dione CAS Name: 2-[[2,5-dimethyl-1-[4-[(5-nitro-2-pyridinyl)oxy]phenyl]-3-pyrrolyl]methylidene]indene-1,3-dione IUPAC Name: 2-[[2,5-dimethyl-1-[4-(5-nitropyridin-2-yl)oxyphenyl]pyrrol-3-yl]methylidene]indene-1,3-dione Traditional Name: 2-[[2,5-dimethyl-1-[4-[(5-nitro-2-pyridyl)oxy]phenyl]pyrrol-3-yl]methylene]indane-1,3-quinone Formula: C27H19N3O5 MolecularWeight: 465.45686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)OC3=NC=C(C=C3)[N+](=O)[O-])C)C=C4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)OC3=NC=C(C=C3)[N+](=O)[O-])C)C=C4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C27H19N3O5/c1-16-13-18(14-24-26(31)22-5-3-4-6-23(22)27(24)32)17(2)29(16)19-7-10-21(11-8-19)35-25-12-9-20(15-28-25)30(33)34/h3-15H,1-2H3