propan-2-yl (2Z)-2-[7-chloranyl-5-(2-fluorophenyl)-4-oxidanyl-3H-1,4-benzodiazepin-2-ylidene]ethanoate

Systemtic Name: propan-2-yl (2Z)-2-[7-chloranyl-5-(2-fluorophenyl)-4-oxidanyl-3H-1,4-benzodiazepin-2-ylidene]ethanoate Openeye Name: isopropyl (2Z)-2-[7-chloro-5-(2-fluorophenyl)-4-hydroxy-3H-1,4-benzodiazepin-2-ylidene]acetate CAS Name: (2Z)-2-[7-chloro-5-(2-fluorophenyl)-4-hydroxy-3H-1,4-benzodiazepin-2-ylidene]acetic acid propan-2-yl ester IUPAC Name: propan-2-yl (2Z)-2-[7-chloro-5-(2-fluorophenyl)-4-hydroxy-3H-1,4-benzodiazepin-2-ylidene]acetate Traditional Name: (2Z)-2-[7-chloro-5-(2-fluorophenyl)-4-hydroxy-3H-1,4-benzodiazepin-2-ylidene]acetic acid isopropyl ester Formula: C20H18ClFN2O3 MolecularWeight: 388.819923

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C=C1CN(C(=C2C=C(C=CC2=N1)Cl)C3=CC=CC=C3F)O

Isomeric SMILES

CC(C)OC(=O)/C=C\1/CN(C(=C2C=C(C=CC2=N1)Cl)C3=CC=CC=C3F)O

InChI

InChI=1S/C20H18ClFN2O3/c1-12(2)27-19(25)10-14-11-24(26)20(15-5-3-4-6-17(15)22)16-9-13(21)7-8-18(16)23-14/h3-10,12,26H,11H2,1-2H3/b14-10-