5-(4-butylphenyl)-2-[2-(4-nitrophenyl)ethyl]pyrimidine

Systemtic Name: 5-(4-butylphenyl)-2-[2-(4-nitrophenyl)ethyl]pyrimidine Openeye Name: 5-(4-butylphenyl)-2-[2-(4-nitrophenyl)ethyl]pyrimidine CAS Name: 5-(4-butylphenyl)-2-[2-(4-nitrophenyl)ethyl]pyrimidine IUPAC Name: 5-(4-butylphenyl)-2-[2-(4-nitrophenyl)ethyl]pyrimidine Traditional Name: 5-(4-butylphenyl)-2-[2-(4-nitrophenyl)ethyl]pyrimidine Formula: C22H23N3O2 MolecularWeight: 361.43692

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C2=CN=C(N=C2)CCC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCC1=CC=C(C=C1)C2=CN=C(N=C2)CCC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H23N3O2/c1-2-3-4-17-5-10-19(11-6-17)20-15-23-22(24-16-20)14-9-18-7-12-21(13-8-18)25(26)27/h5-8,10-13,15-16H,2-4,9,14H2,1H3