2-[(4-methylcyclohexyl)carbonyl-propan-2-yl-amino]-8-[(5-methylfuran-2-yl)methoxymethyl]dibenzofuran-3-carboxylic acid

Systemtic Name: 2-[(4-methylcyclohexyl)carbonyl-propan-2-yl-amino]-8-[(5-methylfuran-2-yl)methoxymethyl]dibenzofuran-3-carboxylic acid Openeye Name: 2-[isopropyl-(4-methylcyclohexanecarbonyl)amino]-8-[(5-methyl-2-furyl)methoxymethyl]dibenzofuran-3-carboxylic acid CAS Name: 2-[[(4-methylcyclohexyl)-oxomethyl]-propan-2-ylamino]-8-[(5-methyl-2-furanyl)methoxymethyl]-3-dibenzofurancarboxylic acid IUPAC Name: 2-[(4-methylcyclohexanecarbonyl)-propan-2-ylamino]-8-[(5-methylfuran-2-yl)methoxymethyl]dibenzofuran-3-carboxylic acid Traditional Name: 2-[isopropyl-(4-methylcyclohexanecarbonyl)amino]-8-[(5-methyl-2-furyl)methoxymethyl]dibenzofuran-3-carboxylic acid Formula: C31H35NO6 MolecularWeight: 517.6127

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)C(=O)N(C2=C(C=C3C(=C2)C4=C(O3)C=CC(=C4)COCC5=CC=C(O5)C)C(=O)O)C(C)C

Isomeric SMILES

CC1CCC(CC1)C(=O)N(C2=C(C=C3C(=C2)C4=C(O3)C=CC(=C4)COCC5=CC=C(O5)C)C(=O)O)C(C)C

InChI

InChI=1S/C31H35NO6/c1-18(2)32(30(33)22-9-5-19(3)6-10-22)27-14-25-24-13-21(16-36-17-23-11-7-20(4)37-23)8-12-28(24)38-29(25)15-26(27)31(34)35/h7-8,11-15,18-19,22H,5-6,9-10,16-17H2,1-4H3,(H,34,35)