1-[1-[[1-[[3-(2-fluoranylphenoxy)phenyl]methyl]-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-3-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]cyclopent-3-ene-1-carboxylic acid

Systemtic Name: 1-[1-[[1-[[3-(2-fluoranylphenoxy)phenyl]methyl]-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-3-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]cyclopent-3-ene-1-carboxylic acid Openeye Name: 1-[1-[[1-[[3-(2-fluorophenoxy)phenyl]methyl]-2-oxo-4,5-dihydro-3H-1-benzazepin-3-yl]carbamoyl]-3-methyl-butyl]cyclopent-3-ene-1-carboxylic acid CAS Name: 1-[1-[[1-[[3-(2-fluorophenoxy)phenyl]methyl]-2-oxo-4,5-dihydro-3H-1-benzazepin-3-yl]amino]-4-methyl-1-oxopentan-2-yl]-1-cyclopent-3-enecarboxylic acid IUPAC Name: 1-[1-[[1-[[3-(2-fluorophenoxy)phenyl]methyl]-2-oxo-4,5-dihydro-3H-1-benzazepin-3-yl]amino]-4-methyl-1-oxopentan-2-yl]cyclopent-3-ene-1-carboxylic acid Traditional Name: 1-[1-[[1-[3-(2-fluorophenoxy)benzyl]-2-keto-4,5-dihydro-3H-1-benzazepin-3-yl]carbamoyl]-3-methyl-butyl]cyclopent-3-ene-1-carboxylic acid Formula: C35H37FN2O5 MolecularWeight: 584.677083

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC1CCC2=CC=CC=C2N(C1=O)CC3=CC(=CC=C3)OC4=CC=CC=C4F)C5(CC=CC5)C(=O)O

Isomeric SMILES

CC(C)CC(C(=O)NC1CCC2=CC=CC=C2N(C1=O)CC3=CC(=CC=C3)OC4=CC=CC=C4F)C5(CC=CC5)C(=O)O

InChI

InChI=1S/C35H37FN2O5/c1-23(2)20-27(35(34(41)42)18-7-8-19-35)32(39)37-29-17-16-25-11-3-5-14-30(25)38(33(29)40)22-24-10-9-12-26(21-24)43-31-15-6-4-13-28(31)36/h3-15,21,23,27,29H,16-20,22H2,1-2H3,(H,37,39)(H,41,42)