1-butyl-2-[(E)-(4-chloranyl-3-nitro-phenyl)methylideneamino]-4,5-diphenyl-pyrrole-3-carbonitrile

Systemtic Name: 1-butyl-2-[(E)-(4-chloranyl-3-nitro-phenyl)methylideneamino]-4,5-diphenyl-pyrrole-3-carbonitrile Openeye Name: 1-butyl-2-[(E)-(4-chloro-3-nitro-phenyl)methyleneamino]-4,5-diphenyl-pyrrole-3-carbonitrile CAS Name: 1-butyl-2-[(E)-(4-chloro-3-nitrophenyl)methylideneamino]-4,5-diphenyl-3-pyrrolecarbonitrile IUPAC Name: 1-butyl-2-[(E)-(4-chloro-3-nitrophenyl)methylideneamino]-4,5-diphenylpyrrole-3-carbonitrile Traditional Name: 1-butyl-2-[(E)-(4-chloro-3-nitro-benzylidene)amino]-4,5-diphenyl-pyrrole-3-carbonitrile Formula: C28H23ClN4O2 MolecularWeight: 482.96082

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=C1N=CC2=CC(=C(C=C2)Cl)[N+](=O)[O-])C#N)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCCCN1C(=C(C(=C1/N=C/C2=CC(=C(C=C2)Cl)[N+](=O)[O-])C#N)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H23ClN4O2/c1-2-3-16-32-27(22-12-8-5-9-13-22)26(21-10-6-4-7-11-21)23(18-30)28(32)31-19-20-14-15-24(29)25(17-20)33(34)35/h4-15,17,19H,2-3,16H2,1H3/b31-19+