2-[[3-[(E)-2-nitroethenyl]indol-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 2-[[3-[(E)-2-nitroethenyl]indol-1-yl]methyl]benzenecarbonitrile Openeye Name: 2-[[3-[(E)-2-nitrovinyl]indol-1-yl]methyl]benzonitrile CAS Name: 2-[[3-[(E)-2-nitroethenyl]-1-indolyl]methyl]benzonitrile IUPAC Name: 2-[[3-[(E)-2-nitroethenyl]indol-1-yl]methyl]benzonitrile Traditional Name: 2-[[3-[(E)-2-nitrovinyl]indol-1-yl]methyl]benzonitrile Formula: C18H13N3O2 MolecularWeight: 303.31472

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C=C(C3=CC=CC=C32)C=C[N+](=O)[O-])C#N

Isomeric SMILES

C1=CC=C(C(=C1)CN2C=C(C3=CC=CC=C32)/C=C/[N+](=O)[O-])C#N

InChI

InChI=1S/C18H13N3O2/c19-11-14-5-1-2-6-15(14)12-20-13-16(9-10-21(22)23)17-7-3-4-8-18(17)20/h1-10,13H,12H2/b10-9+