(5aS,9aS)-3-phenyl-5a,6,7,8,9,9a-hexahydro-1H-1,5-benzodiazepine

Systemtic Name: (5aS,9aS)-3-phenyl-5a,6,7,8,9,9a-hexahydro-1H-1,5-benzodiazepine Openeye Name: (5aS,9aS)-3-phenyl-5a,6,7,8,9,9a-hexahydro-1H-1,5-benzodiazepine CAS Name: (5aS,9aS)-3-phenyl-5a,6,7,8,9,9a-hexahydro-1H-1,5-benzodiazepine IUPAC Name: (5aS,9aS)-3-phenyl-5a,6,7,8,9,9a-hexahydro-1H-1,5-benzodiazepine Traditional Name: (5aS,9aS)-3-phenyl-5a,6,7,8,9,9a-hexahydro-1H-1,5-benzodiazepine Formula: C15H18N2 MolecularWeight: 226.31682

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2C(C1)NC=C(C=N2)C3=CC=CC=C3

Isomeric SMILES

C1CC[C@H]2[C@H](C1)NC=C(C=N2)C3=CC=CC=C3

InChI

InChI=1S/C15H18N2/c1-2-6-12(7-3-1)13-10-16-14-8-4-5-9-15(14)17-11-13/h1-3,6-7,10-11,14-16H,4-5,8-9H2/t14-,15-/m0/s1