N-[(2S)-1-[(5-bromanyl-2-methoxy-phenyl)methyl-methyl-amino]-3-methyl-1-oxidanylidene-butan-2-yl]-3-methyl-benzamide

Systemtic Name: N-[(2S)-1-[(5-bromanyl-2-methoxy-phenyl)methyl-methyl-amino]-3-methyl-1-oxidanylidene-butan-2-yl]-3-methyl-benzamide Openeye Name: N-[(1S)-1-[(5-bromo-2-methoxy-phenyl)methyl-methyl-carbamoyl]-2-methyl-propyl]-3-methyl-benzamide CAS Name: N-[(2S)-1-[(5-bromo-2-methoxyphenyl)methyl-methylamino]-3-methyl-1-oxobutan-2-yl]-3-methylbenzamide IUPAC Name: N-[(2S)-1-[(5-bromo-2-methoxyphenyl)methyl-methylamino]-3-methyl-1-oxobutan-2-yl]-3-methylbenzamide Traditional Name: N-[(1S)-1-[(5-bromo-2-methoxy-benzyl)-methyl-carbamoyl]-2-methyl-propyl]-3-methyl-benzamide Formula: C22H27BrN2O3 MolecularWeight: 447.36538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC(C(C)C)C(=O)N(C)CC2=C(C=CC(=C2)Br)OC

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N[C@@H](C(C)C)C(=O)N(C)CC2=C(C=CC(=C2)Br)OC

InChI

InChI=1S/C22H27BrN2O3/c1-14(2)20(24-21(26)16-8-6-7-15(3)11-16)22(27)25(4)13-17-12-18(23)9-10-19(17)28-5/h6-12,14,20H,13H2,1-5H3,(H,24,26)/t20-/m0/s1