N-[(2S)-1-[[3-(2-bromoethyloxy)-4-chloranyl-1-oxidanylidene-isochromen-7-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]-4-methyl-benzamide

Systemtic Name: N-[(2S)-1-[[3-(2-bromoethyloxy)-4-chloranyl-1-oxidanylidene-isochromen-7-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]-4-methyl-benzamide Openeye Name: N-[(1S)-1-benzyl-2-[[3-(2-bromoethoxy)-4-chloro-1-oxo-isochromen-7-yl]amino]-2-oxo-ethyl]-4-methyl-benzamide CAS Name: N-[(2S)-1-[[3-(2-bromoethoxy)-4-chloro-1-oxo-2-benzopyran-7-yl]amino]-1-oxo-3-phenylpropan-2-yl]-4-methylbenzamide IUPAC Name: N-[(2S)-1-[[3-(2-bromoethoxy)-4-chloro-1-oxoisochromen-7-yl]amino]-1-oxo-3-phenylpropan-2-yl]-4-methylbenzamide Traditional Name: N-[(1S)-1-benzyl-2-[[3-(2-bromoethoxy)-4-chloro-1-keto-isochromen-7-yl]amino]-2-keto-ethyl]-4-methyl-benzamide Formula: C28H24BrClN2O5 MolecularWeight: 583.85756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(CC2=CC=CC=C2)C(=O)NC3=CC4=C(C=C3)C(=C(OC4=O)OCCBr)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)NC3=CC4=C(C=C3)C(=C(OC4=O)OCCBr)Cl

InChI

InChI=1S/C28H24BrClN2O5/c1-17-7-9-19(10-8-17)25(33)32-23(15-18-5-3-2-4-6-18)26(34)31-20-11-12-21-22(16-20)27(35)37-28(24(21)30)36-14-13-29/h2-12,16,23H,13-15H2,1H3,(H,31,34)(H,32,33)/t23-/m0/s1