[(2S)-1-[(5-methyl-6-oxidanylidene-7H-benzo[d][1]benzazepin-7-yl)amino]-1-oxidanylidene-propan-2-yl] N-[[2,3,6-tris(fluoranyl)phenyl]methyl]carbamate

Systemtic Name: [(2S)-1-[(5-methyl-6-oxidanylidene-7H-benzo[d][1]benzazepin-7-yl)amino]-1-oxidanylidene-propan-2-yl] N-[[2,3,6-tris(fluoranyl)phenyl]methyl]carbamate Openeye Name: [(1S)-1-methyl-2-[(5-methyl-6-oxo-7H-benzo[d][1]benzazepin-7-yl)amino]-2-oxo-ethyl] N-[(2,3,6-trifluorophenyl)methyl]carbamate CAS Name: N-[(2,3,6-trifluorophenyl)methyl]carbamic acid [(2S)-1-[(5-methyl-6-oxo-7H-benzo[d][1]benzazepin-7-yl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-[(5-methyl-6-oxo-7H-benzo[d][1]benzazepin-7-yl)amino]-1-oxopropan-2-yl] N-[(2,3,6-trifluorophenyl)methyl]carbamate Traditional Name: N-(2,3,6-trifluorobenzyl)carbamic acid [(1S)-2-keto-2-[(6-keto-5-methyl-7H-benzo[d][1]benzazepin-7-yl)amino]-1-methyl-ethyl] ester Formula: C26H22F3N3O4 MolecularWeight: 497.46579

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1C2=CC=CC=C2C3=CC=CC=C3N(C1=O)C)OC(=O)NCC4=C(C=CC(=C4F)F)F

Isomeric SMILES

C[C@@H](C(=O)NC1C2=CC=CC=C2C3=CC=CC=C3N(C1=O)C)OC(=O)NCC4=C(C=CC(=C4F)F)F

InChI

InChI=1S/C26H22F3N3O4/c1-14(36-26(35)30-13-18-19(27)11-12-20(28)22(18)29)24(33)31-23-17-9-4-3-7-15(17)16-8-5-6-10-21(16)32(2)25(23)34/h3-12,14,23H,13H2,1-2H3,(H,30,35)(H,31,33)/t14-,23?/m0/s1