ethyl 4-[butyl-[2-[cyclohexyl-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl]amino]-2-oxidanylidene-ethyl]amino]-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[butyl-[2-[cyclohexyl-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl]amino]-2-oxidanylidene-ethyl]amino]-4-oxidanylidene-butanoate Openeye Name: ethyl 4-[butyl-[2-[cyclohexyl-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl]amino]-2-oxo-ethyl]amino]-4-oxo-butanoate CAS Name: 4-[butyl-[2-[cyclohexyl-[[1-[(4-fluorophenyl)methyl]-2-pyrrolyl]methyl]amino]-2-oxoethyl]amino]-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[butyl-[2-[cyclohexyl-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl]amino]-2-oxoethyl]amino]-4-oxobutanoate Traditional Name: 4-[butyl-[2-[cyclohexyl-[[1-(4-fluorobenzyl)pyrrol-2-yl]methyl]amino]-2-keto-ethyl]amino]-4-keto-butyric acid ethyl ester Formula: C30H42FN3O4 MolecularWeight: 527.670583

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(=O)N(CC1=CC=CN1CC2=CC=C(C=C2)F)C3CCCCC3)C(=O)CCC(=O)OCC

Isomeric SMILES

CCCCN(CC(=O)N(CC1=CC=CN1CC2=CC=C(C=C2)F)C3CCCCC3)C(=O)CCC(=O)OCC

InChI

InChI=1S/C30H42FN3O4/c1-3-5-19-33(28(35)17-18-30(37)38-4-2)23-29(36)34(26-10-7-6-8-11-26)22-27-12-9-20-32(27)21-24-13-15-25(31)16-14-24/h9,12-16,20,26H,3-8,10-11,17-19,21-23H2,1-2H3