methyl 5-[[1-(4-tert-butylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]-2-chloranyl-benzoate

Systemtic Name: methyl 5-[[1-(4-tert-butylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]-2-chloranyl-benzoate Openeye Name: methyl 5-[[1-(4-tert-butylphenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-2-chloro-benzoate CAS Name: 5-[[1-(4-tert-butylphenyl)-2,5-dimethyl-3-pyrrolyl]methylideneamino]-2-chlorobenzoic acid methyl ester IUPAC Name: methyl 5-[[1-(4-tert-butylphenyl)-2,5-dimethylpyrrol-3-yl]methylideneamino]-2-chlorobenzoate Traditional Name: 5-[[1-(4-tert-butylphenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-2-chloro-benzoic acid methyl ester Formula: C25H27ClN2O2 MolecularWeight: 422.94708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)C(C)(C)C)C)C=NC3=CC(=C(C=C3)Cl)C(=O)OC

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)C(C)(C)C)C)C=NC3=CC(=C(C=C3)Cl)C(=O)OC

InChI

InChI=1S/C25H27ClN2O2/c1-16-13-18(15-27-20-9-12-23(26)22(14-20)24(29)30-6)17(2)28(16)21-10-7-19(8-11-21)25(3,4)5/h7-15H,1-6H3