4-[2-(4-methoxyphenyl)pyrrolidin-1-yl]-3-nitro-benzenecarbonitrile

Systemtic Name: 4-[2-(4-methoxyphenyl)pyrrolidin-1-yl]-3-nitro-benzenecarbonitrile Openeye Name: 4-[2-(4-methoxyphenyl)pyrrolidin-1-yl]-3-nitro-benzonitrile CAS Name: 4-[2-(4-methoxyphenyl)-1-pyrrolidinyl]-3-nitrobenzonitrile IUPAC Name: 4-[2-(4-methoxyphenyl)pyrrolidin-1-yl]-3-nitrobenzonitrile Traditional Name: 4-[2-(4-methoxyphenyl)pyrrolidino]-3-nitro-benzonitrile Formula: C18H17N3O3 MolecularWeight: 323.34588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CCCN2C3=C(C=C(C=C3)C#N)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C2CCCN2C3=C(C=C(C=C3)C#N)[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O3/c1-24-15-7-5-14(6-8-15)16-3-2-10-20(16)17-9-4-13(12-19)11-18(17)21(22)23/h4-9,11,16H,2-3,10H2,1H3