ethyl 2-[[1a-[(4-methylphenyl)carbamoyl]-2-oxidanylidene-1,7b-dihydrocyclopropa[c]chromen-1-yl]carbonyl]-2-ethyl-butanoate

Systemtic Name: ethyl 2-[[1a-[(4-methylphenyl)carbamoyl]-2-oxidanylidene-1,7b-dihydrocyclopropa[c]chromen-1-yl]carbonyl]-2-ethyl-butanoate Openeye Name: ethyl 2-ethyl-2-[2-oxo-1a-(p-tolylcarbamoyl)-1,7b-dihydrocyclopropa[c]chromene-1-carbonyl]butanoate CAS Name: 2-[[1a-[(4-methylanilino)-oxomethyl]-2-oxo-1,7b-dihydrocyclopropa[c][1]benzopyran-1-yl]-oxomethyl]-2-ethylbutanoic acid ethyl ester IUPAC Name: ethyl 2-[1a-[(4-methylphenyl)carbamoyl]-2-oxo-1,7b-dihydrocyclopropa[c]chromene-1-carbonyl]-2-ethylbutanoate Traditional Name: 2-ethyl-2-[2-keto-1a-(p-tolylcarbamoyl)-1,7b-dihydrocyclopropa[c]chromene-1-carbonyl]butyric acid ethyl ester Formula: C27H29NO6 MolecularWeight: 463.52226

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C(=O)C1C2C1(C(=O)OC3=CC=CC=C23)C(=O)NC4=CC=C(C=C4)C)C(=O)OCC

Isomeric SMILES

CCC(CC)(C(=O)C1C2C1(C(=O)OC3=CC=CC=C23)C(=O)NC4=CC=C(C=C4)C)C(=O)OCC

InChI

InChI=1S/C27H29NO6/c1-5-26(6-2,24(31)33-7-3)22(29)21-20-18-10-8-9-11-19(18)34-25(32)27(20,21)23(30)28-17-14-12-16(4)13-15-17/h8-15,20-21H,5-7H2,1-4H3,(H,28,30)