3-[4-(4-nitrophenoxy)phenyl]-2,5,6,7,8,8a-hexahydro-1H-indolizine-3-carbonitrile

Systemtic Name: 3-[4-(4-nitrophenoxy)phenyl]-2,5,6,7,8,8a-hexahydro-1H-indolizine-3-carbonitrile Openeye Name: 3-[4-(4-nitrophenoxy)phenyl]-2,5,6,7,8,8a-hexahydro-1H-indolizine-3-carbonitrile CAS Name: 3-[4-(4-nitrophenoxy)phenyl]-2,5,6,7,8,8a-hexahydro-1H-indolizine-3-carbonitrile IUPAC Name: 3-[4-(4-nitrophenoxy)phenyl]-2,5,6,7,8,8a-hexahydro-1H-indolizine-3-carbonitrile Traditional Name: 3-[4-(4-nitrophenoxy)phenyl]indolizidine-3-carbonitrile Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN2C(C1)CCC2(C#N)C3=CC=C(C=C3)OC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCN2C(C1)CCC2(C#N)C3=CC=C(C=C3)OC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H21N3O3/c22-15-21(13-12-17-3-1-2-14-23(17)21)16-4-8-19(9-5-16)27-20-10-6-18(7-11-20)24(25)26/h4-11,17H,1-3,12-14H2