methyl (2Z)-2-[8-chloranyl-7-methoxy-3,5-bis(oxidanylidene)-1H-1,4-benzodiazepin-2-ylidene]ethanoate

Systemtic Name: methyl (2Z)-2-[8-chloranyl-7-methoxy-3,5-bis(oxidanylidene)-1H-1,4-benzodiazepin-2-ylidene]ethanoate Openeye Name: methyl (2Z)-2-(8-chloro-7-methoxy-3,5-dioxo-1H-1,4-benzodiazepin-2-ylidene)acetate CAS Name: (2Z)-2-(8-chloro-7-methoxy-3,5-dioxo-1H-1,4-benzodiazepin-2-ylidene)acetic acid methyl ester IUPAC Name: methyl (2Z)-2-(8-chloro-7-methoxy-3,5-dioxo-1H-1,4-benzodiazepin-2-ylidene)acetate Traditional Name: (2Z)-2-(8-chloro-3,5-diketo-7-methoxy-1H-1,4-benzodiazepin-2-ylidene)acetic acid methyl ester Formula: C13H11ClN2O5 MolecularWeight: 310.68984

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=O)NC(=O)C(=CC(=O)OC)N2)Cl

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=O)NC(=O)/C(=C/C(=O)OC)/N2)Cl

InChI

InChI=1S/C13H11ClN2O5/c1-20-10-3-6-8(4-7(10)14)15-9(5-11(17)21-2)13(19)16-12(6)18/h3-5,15H,1-2H3,(H,16,18,19)/b9-5-