4-[2-(4,5-dinitronaphthalen-1-yl)ethynyl]-N,N-bis(phenylmethyl)aniline

Systemtic Name: 4-[2-(4,5-dinitronaphthalen-1-yl)ethynyl]-N,N-bis(phenylmethyl)aniline Openeye Name: N,N-dibenzyl-4-[2-(4,5-dinitro-1-naphthyl)ethynyl]aniline CAS Name: 4-[2-(4,5-dinitro-1-naphthalenyl)ethynyl]-N,N-bis(phenylmethyl)aniline IUPAC Name: N,N-dibenzyl-4-[2-(4,5-dinitronaphthalen-1-yl)ethynyl]aniline Traditional Name: dibenzyl-[4-[2-(4,5-dinitro-1-naphthyl)ethynyl]phenyl]amine Formula: C32H23N3O4 MolecularWeight: 513.54272

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C3=CC=C(C=C3)C#CC4=C5C=CC=C(C5=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C3=CC=C(C=C3)C#CC4=C5C=CC=C(C5=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C32H23N3O4/c36-34(37)30-13-7-12-29-27(18-21-31(32(29)30)35(38)39)17-14-24-15-19-28(20-16-24)33(22-25-8-3-1-4-9-25)23-26-10-5-2-6-11-26/h1-13,15-16,18-21H,22-23H2