[(S)-(2-acetamido-5-bromanyl-phenyl)-phenyl-methyl]-(2-methoxy-2-oxidanylidene-ethyl)azanium

Systemtic Name: [(S)-(2-acetamido-5-bromanyl-phenyl)-phenyl-methyl]-(2-methoxy-2-oxidanylidene-ethyl)azanium Openeye Name: [(S)-(2-acetamido-5-bromo-phenyl)-phenyl-methyl]-(2-methoxy-2-oxo-ethyl)ammonium CAS Name: [(S)-(2-acetamido-5-bromophenyl)-phenylmethyl]-(2-methoxy-2-oxoethyl)ammonium IUPAC Name: [(S)-(2-acetamido-5-bromophenyl)-phenylmethyl]-(2-methoxy-2-oxoethyl)azanium Traditional Name: [(S)-(2-acetamido-5-bromo-phenyl)-phenyl-methyl]-(2-keto-2-methoxy-ethyl)ammonium Formula: C18H20BrN2O3+ MolecularWeight: 392.267

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)Br)C(C2=CC=CC=C2)[NH2+]CC(=O)OC

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)Br)[C@H](C2=CC=CC=C2)[NH2+]CC(=O)OC

InChI

InChI=1S/C18H19BrN2O3/c1-12(22)21-16-9-8-14(19)10-15(16)18(20-11-17(23)24-2)13-6-4-3-5-7-13/h3-10,18,20H,11H2,1-2H3,(H,21,22)/p+1/t18-/m0/s1