1-[2-(4-methoxyphenyl)pyrrolidin-1-yl]-7-(5-methylthiophen-2-yl)heptane-1,4,7-trione

Systemtic Name: 1-[2-(4-methoxyphenyl)pyrrolidin-1-yl]-7-(5-methylthiophen-2-yl)heptane-1,4,7-trione Openeye Name: 1-[2-(4-methoxyphenyl)pyrrolidin-1-yl]-7-(5-methyl-2-thienyl)heptane-1,4,7-trione CAS Name: 1-[2-(4-methoxyphenyl)-1-pyrrolidinyl]-7-(5-methyl-2-thiophenyl)heptane-1,4,7-trione IUPAC Name: 1-[2-(4-methoxyphenyl)pyrrolidin-1-yl]-7-(5-methylthiophen-2-yl)heptane-1,4,7-trione Traditional Name: 1-[2-(4-methoxyphenyl)pyrrolidino]-7-(5-methyl-2-thienyl)heptane-1,4,7-trione Formula: C23H27NO4S MolecularWeight: 413.52978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)CCC(=O)CCC(=O)N2CCCC2C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC=C(S1)C(=O)CCC(=O)CCC(=O)N2CCCC2C3=CC=C(C=C3)OC

InChI

InChI=1S/C23H27NO4S/c1-16-5-13-22(29-16)21(26)12-8-18(25)9-14-23(27)24-15-3-4-20(24)17-6-10-19(28-2)11-7-17/h5-7,10-11,13,20H,3-4,8-9,12,14-15H2,1-2H3