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

Systemtic Name: butyl 3-[[4-chloranyl-1-naphthalen-1-yl-2,5-bis(oxidanylidene)pyrrol-3-yl]amino]benzoate Openeye Name: butyl 3-[[4-chloro-1-(1-naphthyl)-2,5-dioxo-pyrrol-3-yl]amino]benzoate CAS Name: 3-[[4-chloro-1-(1-naphthalenyl)-2,5-dioxo-3-pyrrolyl]amino]benzoic acid butyl ester IUPAC Name: butyl 3-[(4-chloro-1-naphthalen-1-yl-2,5-dioxopyrrol-3-yl)amino]benzoate Traditional Name: 3-[[4-chloro-2,5-diketo-1-(1-naphthyl)-3-pyrrolin-3-yl]amino]benzoic acid butyl ester Formula: C25H21ClN2O4 MolecularWeight: 448.89824

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC(=CC=C1)NC2=C(C(=O)N(C2=O)C3=CC=CC4=CC=CC=C43)Cl

Isomeric SMILES

CCCCOC(=O)C1=CC(=CC=C1)NC2=C(C(=O)N(C2=O)C3=CC=CC4=CC=CC=C43)Cl

InChI

InChI=1S/C25H21ClN2O4/c1-2-3-14-32-25(31)17-10-6-11-18(15-17)27-22-21(26)23(29)28(24(22)30)20-13-7-9-16-8-4-5-12-19(16)20/h4-13,15,27H,2-3,14H2,1H3