2-[2-(4,11-dimethyl-2-oxidanylidene-6,7,8,9-tetrahydro-[1]benzofuro[3,2-g]chromen-3-yl)ethanoylamino]-3-methyl-pentanoic acid

Systemtic Name: 2-[2-(4,11-dimethyl-2-oxidanylidene-6,7,8,9-tetrahydro-[1]benzofuro[3,2-g]chromen-3-yl)ethanoylamino]-3-methyl-pentanoic acid Openeye Name: 2-[[2-(4,11-dimethyl-2-oxo-6,7,8,9-tetrahydrobenzofuro[3,2-g]chromen-3-yl)acetyl]amino]-3-methyl-pentanoic acid CAS Name: 2-[[2-(4,11-dimethyl-2-oxo-6,7,8,9-tetrahydrobenzofuro[3,2-g][1]benzopyran-3-yl)-1-oxoethyl]amino]-3-methylpentanoic acid IUPAC Name: 2-[[2-(4,11-dimethyl-2-oxo-6,7,8,9-tetrahydro-[1]benzofuro[3,2-g]chromen-3-yl)acetyl]amino]-3-methylpentanoic acid Traditional Name: 2-[[2-(2-keto-4,11-dimethyl-6,7,8,9-tetrahydrobenzofuro[3,2-g]chromen-3-yl)acetyl]amino]-3-methyl-valeric acid Formula: C25H29NO6 MolecularWeight: 439.50086

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)NC(=O)CC1=C(C2=C(C(=C3C(=C2)C4=C(O3)CCCC4)C)OC1=O)C

Isomeric SMILES

CCC(C)C(C(=O)O)NC(=O)CC1=C(C2=C(C(=C3C(=C2)C4=C(O3)CCCC4)C)OC1=O)C

InChI

InChI=1S/C25H29NO6/c1-5-12(2)21(24(28)29)26-20(27)11-17-13(3)16-10-18-15-8-6-7-9-19(15)31-23(18)14(4)22(16)32-25(17)30/h10,12,21H,5-9,11H2,1-4H3,(H,26,27)(H,28,29)