methyl 2-[3-chloranyl-2,5-bis(oxidanylidene)-4-(1-phenylethylamino)pyrrol-1-yl]benzoate

Systemtic Name: methyl 2-[3-chloranyl-2,5-bis(oxidanylidene)-4-(1-phenylethylamino)pyrrol-1-yl]benzoate Openeye Name: methyl 2-[3-chloro-2,5-dioxo-4-(1-phenylethylamino)pyrrol-1-yl]benzoate CAS Name: 2-[3-chloro-2,5-dioxo-4-(1-phenylethylamino)-1-pyrrolyl]benzoic acid methyl ester IUPAC Name: methyl 2-[3-chloro-2,5-dioxo-4-(1-phenylethylamino)pyrrol-1-yl]benzoate Traditional Name: 2-[3-chloro-2,5-diketo-4-(1-phenylethylamino)-3-pyrrolin-1-yl]benzoic acid methyl ester Formula: C20H17ClN2O4 MolecularWeight: 384.81298

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC2=C(C(=O)N(C2=O)C3=CC=CC=C3C(=O)OC)Cl

Isomeric SMILES

CC(C1=CC=CC=C1)NC2=C(C(=O)N(C2=O)C3=CC=CC=C3C(=O)OC)Cl

InChI

InChI=1S/C20H17ClN2O4/c1-12(13-8-4-3-5-9-13)22-17-16(21)18(24)23(19(17)25)15-11-7-6-10-14(15)20(26)27-2/h3-12,22H,1-2H3