[2-[[(1S)-1-(4-bromophenyl)ethyl]amino]-2-oxidanylidene-ethyl]-cycloheptyl-methyl-azanium

Systemtic Name: [2-[[(1S)-1-(4-bromophenyl)ethyl]amino]-2-oxidanylidene-ethyl]-cycloheptyl-methyl-azanium Openeye Name: [2-[[(1S)-1-(4-bromophenyl)ethyl]amino]-2-oxo-ethyl]-cycloheptyl-methyl-ammonium CAS Name: [2-[[(1S)-1-(4-bromophenyl)ethyl]amino]-2-oxoethyl]-cycloheptyl-methylammonium IUPAC Name: [2-[[(1S)-1-(4-bromophenyl)ethyl]amino]-2-oxoethyl]-cycloheptyl-methylazanium Traditional Name: [2-[[(1S)-1-(4-bromophenyl)ethyl]amino]-2-keto-ethyl]-cycloheptyl-methyl-ammonium Formula: C18H28BrN2O+ MolecularWeight: 368.33172

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)Br)NC(=O)C[NH+](C)C2CCCCCC2

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)Br)NC(=O)C[NH+](C)C2CCCCCC2

InChI

InChI=1S/C18H27BrN2O/c1-14(15-9-11-16(19)12-10-15)20-18(22)13-21(2)17-7-5-3-4-6-8-17/h9-12,14,17H,3-8,13H2,1-2H3,(H,20,22)/p+1/t14-/m0/s1