2-[2-methyl-8-[methyl-(2-oxidanyl-2-phenyl-ethyl)carbamoyl]-3-oxidanylidene-4,5-dihydro-1H-2-benzazepin-4-yl]ethanoic acid

Systemtic Name: 2-[2-methyl-8-[methyl-(2-oxidanyl-2-phenyl-ethyl)carbamoyl]-3-oxidanylidene-4,5-dihydro-1H-2-benzazepin-4-yl]ethanoic acid Openeye Name: 2-[8-[(2-hydroxy-2-phenyl-ethyl)-methyl-carbamoyl]-2-methyl-3-oxo-4,5-dihydro-1H-2-benzazepin-4-yl]acetic acid CAS Name: 2-[8-[[(2-hydroxy-2-phenylethyl)-methylamino]-oxomethyl]-2-methyl-3-oxo-4,5-dihydro-1H-2-benzazepin-4-yl]acetic acid IUPAC Name: 2-[8-[(2-hydroxy-2-phenylethyl)-methylcarbamoyl]-2-methyl-3-oxo-4,5-dihydro-1H-2-benzazepin-4-yl]acetic acid Traditional Name: 2-[8-[(2-hydroxy-2-phenyl-ethyl)-methyl-carbamoyl]-3-keto-2-methyl-4,5-dihydro-1H-2-benzazepin-4-yl]acetic acid Formula: C23H26N2O5 MolecularWeight: 410.46294

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC2=C(CC(C1=O)CC(=O)O)C=CC(=C2)C(=O)N(C)CC(C3=CC=CC=C3)O

Isomeric SMILES

CN1CC2=C(CC(C1=O)CC(=O)O)C=CC(=C2)C(=O)N(C)CC(C3=CC=CC=C3)O

InChI

InChI=1S/C23H26N2O5/c1-24-13-19-11-17(9-8-16(19)10-18(23(24)30)12-21(27)28)22(29)25(2)14-20(26)15-6-4-3-5-7-15/h3-9,11,18,20,26H,10,12-14H2,1-2H3,(H,27,28)