4-[bis(2-oxidanylidene-1-phenyl-cyclohepta[b]pyrrol-3-yl)methyl]benzenecarbonitrile

Systemtic Name: 4-[bis(2-oxidanylidene-1-phenyl-cyclohepta[b]pyrrol-3-yl)methyl]benzenecarbonitrile Openeye Name: 4-[bis(2-oxo-1-phenyl-cyclohepta[b]pyrrol-3-yl)methyl]benzonitrile CAS Name: 4-[bis(2-oxo-1-phenyl-3-cyclohepta[b]pyrrolyl)methyl]benzonitrile IUPAC Name: 4-[bis(2-oxo-1-phenylcyclohepta[b]pyrrol-3-yl)methyl]benzonitrile Traditional Name: 4-[bis(2-keto-1-phenyl-cyclohepta[b]pyrrol-3-yl)methyl]benzonitrile Formula: C38H25N3O2 MolecularWeight: 555.624

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=CC=CC=CC3=C(C2=O)C(C4=CC=C(C=C4)C#N)C5=C6C=CC=CC=C6N(C5=O)C7=CC=CC=C7

Isomeric SMILES

C1=CC=C(C=C1)N2C3=CC=CC=CC3=C(C2=O)C(C4=CC=C(C=C4)C#N)C5=C6C=CC=CC=C6N(C5=O)C7=CC=CC=C7

InChI

InChI=1S/C38H25N3O2/c39-25-26-21-23-27(24-22-26)34(35-30-17-9-3-11-19-32(30)40(37(35)42)28-13-5-1-6-14-28)36-31-18-10-4-12-20-33(31)41(38(36)43)29-15-7-2-8-16-29/h1-24,34H