(4R,6S)-11-azanyl-4-pentyl-5-phenyl-5-azaspiro[5.5]undec-10-ene-10-carbonitrile

Systemtic Name: (4R,6S)-11-azanyl-4-pentyl-5-phenyl-5-azaspiro[5.5]undec-10-ene-10-carbonitrile Openeye Name: (4R,6S)-11-amino-4-pentyl-5-phenyl-5-azaspiro[5.5]undec-10-ene-10-carbonitrile CAS Name: (4R,6S)-11-amino-4-pentyl-5-phenyl-5-azaspiro[5.5]undec-10-ene-10-carbonitrile IUPAC Name: (4R,6S)-11-amino-4-pentyl-5-phenyl-5-azaspiro[5.5]undec-10-ene-10-carbonitrile Traditional Name: (4R,6S)-11-amino-4-amyl-5-phenyl-5-azaspiro[5.5]undec-10-ene-10-carbonitrile Formula: C22H31N3 MolecularWeight: 337.50164

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCCC2(N1C3=CC=CC=C3)CCCC(=C2N)C#N

Isomeric SMILES

CCCCC[C@@H]1CCC[C@@]2(N1C3=CC=CC=C3)CCCC(=C2N)C#N

InChI

InChI=1S/C22H31N3/c1-2-3-5-11-20-14-9-16-22(15-8-10-18(17-23)21(22)24)25(20)19-12-6-4-7-13-19/h4,6-7,12-13,20H,2-3,5,8-11,14-16,24H2,1H3/t20-,22+/m1/s1