[(1S)-2-[(5-chloranyl-3,6-dimethyl-1-benzofuran-2-yl)carbonylamino]-1-phenyl-ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-2-[(5-chloranyl-3,6-dimethyl-1-benzofuran-2-yl)carbonylamino]-1-phenyl-ethyl]-dimethyl-azanium Openeye Name: [(1S)-2-[(5-chloro-3,6-dimethyl-benzofuran-2-carbonyl)amino]-1-phenyl-ethyl]-dimethyl-ammonium CAS Name: [(1S)-2-[[(5-chloro-3,6-dimethyl-2-benzofuranyl)-oxomethyl]amino]-1-phenylethyl]-dimethylammonium IUPAC Name: [(1S)-2-[(5-chloro-3,6-dimethyl-1-benzofuran-2-carbonyl)amino]-1-phenylethyl]-dimethylazanium Traditional Name: [(1S)-2-[(5-chloro-3,6-dimethyl-benzofuran-2-carbonyl)amino]-1-phenyl-ethyl]-dimethyl-ammonium Formula: C21H24ClN2O2+ MolecularWeight: 371.88046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C(OC2=C1)C(=O)NCC(C3=CC=CC=C3)[NH+](C)C)C)Cl

Isomeric SMILES

CC1=C(C=C2C(=C(OC2=C1)C(=O)NC[C@H](C3=CC=CC=C3)[NH+](C)C)C)Cl

InChI

InChI=1S/C21H23ClN2O2/c1-13-10-19-16(11-17(13)22)14(2)20(26-19)21(25)23-12-18(24(3)4)15-8-6-5-7-9-15/h5-11,18H,12H2,1-4H3,(H,23,25)/p+1/t18-/m1/s1