(E)-2-(3-nitrophenyl)carbonyl-3-(1,2,5-triphenylpyrrol-3-yl)prop-2-enenitrile

Systemtic Name: (E)-2-(3-nitrophenyl)carbonyl-3-(1,2,5-triphenylpyrrol-3-yl)prop-2-enenitrile Openeye Name: (E)-2-(3-nitrobenzoyl)-3-(1,2,5-triphenylpyrrol-3-yl)prop-2-enenitrile CAS Name: (E)-2-[(3-nitrophenyl)-oxomethyl]-3-(1,2,5-triphenyl-3-pyrrolyl)-2-propenenitrile IUPAC Name: (E)-2-(3-nitrobenzoyl)-3-(1,2,5-triphenylpyrrol-3-yl)prop-2-enenitrile Traditional Name: (E)-2-(3-nitrobenzoyl)-3-(1,2,5-triphenylpyrrol-3-yl)acrylonitrile Formula: C32H21N3O3 MolecularWeight: 495.52744

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=C(N2C3=CC=CC=C3)C4=CC=CC=C4)C=C(C#N)C(=O)C5=CC(=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=C(N2C3=CC=CC=C3)C4=CC=CC=C4)/C=C(\C#N)/C(=O)C5=CC(=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C32H21N3O3/c33-22-27(32(36)25-15-10-18-29(20-25)35(37)38)19-26-21-30(23-11-4-1-5-12-23)34(28-16-8-3-9-17-28)31(26)24-13-6-2-7-14-24/h1-21H/b27-19+