(3S)-1-(phenylmethyl)-1,2,3,4,5,8-hexahydroazocin-1-ium-3-carboxamide

Systemtic Name: (3S)-1-(phenylmethyl)-1,2,3,4,5,8-hexahydroazocin-1-ium-3-carboxamide Openeye Name: (3S)-1-benzyl-1,2,3,4,5,8-hexahydroazocin-1-ium-3-carboxamide CAS Name: (3S)-1-(phenylmethyl)-1,2,3,4,5,8-hexahydroazocin-1-ium-3-carboxamide IUPAC Name: (3S)-1-benzyl-1,2,3,4,5,8-hexahydroazocin-1-ium-3-carboxamide Traditional Name: (3S)-1-benzyl-1,2,3,4,5,8-hexahydroazocin-1-ium-3-carboxamide Formula: C15H21N2O+ MolecularWeight: 245.34004

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](CC=C1)CC2=CC=CC=C2)C(=O)N

Isomeric SMILES

C1C[C@@H](C[NH+](CC=C1)CC2=CC=CC=C2)C(=O)N

InChI

InChI=1S/C15H20N2O/c16-15(18)14-9-5-2-6-10-17(12-14)11-13-7-3-1-4-8-13/h1-4,6-8,14H,5,9-12H2,(H2,16,18)/p+1/t14-/m0/s1