4-methyl-1-[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]-1,4-diazepan-1-ium-5-one

Systemtic Name: 4-methyl-1-[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]-1,4-diazepan-1-ium-5-one Openeye Name: 4-methyl-1-[(2S)-tetralin-2-yl]-1,4-diazepan-1-ium-5-one CAS Name: 4-methyl-1-[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]-1,4-diazepan-1-ium-5-one IUPAC Name: 4-methyl-1-[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]-1,4-diazepan-1-ium-5-one Traditional Name: 4-methyl-1-[(2S)-tetralin-2-yl]-1,4-diazepan-1-ium-5-one Formula: C16H23N2O+ MolecularWeight: 259.36662

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC[NH+](CCC1=O)C2CCC3=CC=CC=C3C2

Isomeric SMILES

CN1CC[NH+](CCC1=O)[C@H]2CCC3=CC=CC=C3C2

InChI

InChI=1S/C16H22N2O/c1-17-10-11-18(9-8-16(17)19)15-7-6-13-4-2-3-5-14(13)12-15/h2-5,15H,6-12H2,1H3/p+1/t15-/m0/s1