(2-methylphenyl) 4-[[4-chloranyl-1-naphthalen-1-yl-2,5-bis(oxidanylidene)pyrrol-3-yl]amino]benzoate

Systemtic Name: (2-methylphenyl) 4-[[4-chloranyl-1-naphthalen-1-yl-2,5-bis(oxidanylidene)pyrrol-3-yl]amino]benzoate Openeye Name: o-tolyl 4-[[4-chloro-1-(1-naphthyl)-2,5-dioxo-pyrrol-3-yl]amino]benzoate CAS Name: 4-[[4-chloro-1-(1-naphthalenyl)-2,5-dioxo-3-pyrrolyl]amino]benzoic acid (2-methylphenyl) ester IUPAC Name: (2-methylphenyl) 4-[(4-chloro-1-naphthalen-1-yl-2,5-dioxopyrrol-3-yl)amino]benzoate Traditional Name: 4-[[4-chloro-2,5-diketo-1-(1-naphthyl)-3-pyrrolin-3-yl]amino]benzoic acid o-tolyl ester Formula: C28H19ClN2O4 MolecularWeight: 482.91446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OC(=O)C2=CC=C(C=C2)NC3=C(C(=O)N(C3=O)C4=CC=CC5=CC=CC=C54)Cl

Isomeric SMILES

CC1=CC=CC=C1OC(=O)C2=CC=C(C=C2)NC3=C(C(=O)N(C3=O)C4=CC=CC5=CC=CC=C54)Cl

InChI

InChI=1S/C28H19ClN2O4/c1-17-7-2-5-12-23(17)35-28(34)19-13-15-20(16-14-19)30-25-24(29)26(32)31(27(25)33)22-11-6-9-18-8-3-4-10-21(18)22/h2-16,30H,1H3