(3aS,6aR)-4-butyl-5-[(E)-oct-4-en-4-yl]-N-phenyl-2,3,6,6a-tetrahydro-1H-pentalen-3a-amine

Systemtic Name: (3aS,6aR)-4-butyl-5-[(E)-oct-4-en-4-yl]-N-phenyl-2,3,6,6a-tetrahydro-1H-pentalen-3a-amine Openeye Name: (3aS,6aR)-4-butyl-N-phenyl-5-[(E)-1-propylpent-1-enyl]-2,3,6,6a-tetrahydro-1H-pentalen-3a-amine CAS Name: (3aS,6aR)-4-butyl-5-[(E)-oct-4-en-4-yl]-N-phenyl-2,3,6,6a-tetrahydro-1H-pentalen-3a-amine IUPAC Name: (3aS,6aR)-4-butyl-5-[(E)-oct-4-en-4-yl]-N-phenyl-2,3,6,6a-tetrahydro-1H-pentalen-3a-amine Traditional Name: [(3aS,6aR)-4-butyl-5-[(E)-1-propylpent-1-enyl]-2,3,6,6a-tetrahydro-1H-pentalen-3a-yl]-phenyl-amine Formula: C26H39N MolecularWeight: 365.59456

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(CC2C1(CCC2)NC3=CC=CC=C3)C(=CCCC)CCC

Isomeric SMILES

CCCCC1=C(C[C@@H]2[C@]1(CCC2)NC3=CC=CC=C3)/C(=C/CCC)/CCC

InChI

InChI=1S/C26H39N/c1-4-7-14-21(13-6-3)24-20-22-15-12-19-26(22,25(24)18-8-5-2)27-23-16-10-9-11-17-23/h9-11,14,16-17,22,27H,4-8,12-13,15,18-20H2,1-3H3/b21-14+/t22-,26+/m1/s1