methyl 3-[2-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]ethanoylamino]-4-methyl-benzoate

Systemtic Name: methyl 3-[2-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]ethanoylamino]-4-methyl-benzoate Openeye Name: methyl 3-[[2-(1,3-dioxo-4H-isoquinolin-2-yl)acetyl]amino]-4-methyl-benzoate CAS Name: 3-[[2-(1,3-dioxo-4H-isoquinolin-2-yl)-1-oxoethyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[2-(1,3-dioxo-4H-isoquinolin-2-yl)acetyl]amino]-4-methylbenzoate Traditional Name: 3-[[2-(1,3-diketo-4H-isoquinolin-2-yl)acetyl]amino]-4-methyl-benzoic acid methyl ester Formula: C20H18N2O5 MolecularWeight: 366.36732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CN2C(=O)CC3=CC=CC=C3C2=O

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CN2C(=O)CC3=CC=CC=C3C2=O

InChI

InChI=1S/C20H18N2O5/c1-12-7-8-14(20(26)27-2)9-16(12)21-17(23)11-22-18(24)10-13-5-3-4-6-15(13)19(22)25/h3-9H,10-11H2,1-2H3,(H,21,23)