2-[[3-(1,3-benzodioxol-5-yl)-5,5-diethoxy-pentan-2-yl]-(naphthalen-2-ylmethyl)carbamoyl]-5-oxidanylidene-oxolane-3-carboxylate

Systemtic Name: 2-[[3-(1,3-benzodioxol-5-yl)-5,5-diethoxy-pentan-2-yl]-(naphthalen-2-ylmethyl)carbamoyl]-5-oxidanylidene-oxolane-3-carboxylate Openeye Name: 2-[[2-(1,3-benzodioxol-5-yl)-4,4-diethoxy-1-methyl-butyl]-(2-naphthylmethyl)carbamoyl]-5-oxo-tetrahydrofuran-3-carboxylate CAS Name: 2-[[[3-(1,3-benzodioxol-5-yl)-5,5-diethoxypentan-2-yl]-(2-naphthalenylmethyl)amino]-oxomethyl]-5-oxo-3-oxolanecarboxylate IUPAC Name: 2-[[3-(1,3-benzodioxol-5-yl)-5,5-diethoxypentan-2-yl]-(naphthalen-2-ylmethyl)carbamoyl]-5-oxooxolane-3-carboxylate Traditional Name: 2-[[2-(1,3-benzodioxol-5-yl)-4,4-diethoxy-1-methyl-butyl]-(2-naphthylmethyl)carbamoyl]-5-keto-tetrahydrofuran-3-carboxylate Formula: C33H36NO9- MolecularWeight: 590.64024

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC(C1=CC2=C(C=C1)OCO2)C(C)N(CC3=CC4=CC=CC=C4C=C3)C(=O)C5C(CC(=O)O5)C(=O)[O-])OCC

Isomeric SMILES

CCOC(CC(C1=CC2=C(C=C1)OCO2)C(C)N(CC3=CC4=CC=CC=C4C=C3)C(=O)C5C(CC(=O)O5)C(=O)[O-])OCC

InChI

InChI=1S/C33H37NO9/c1-4-39-30(40-5-2)17-25(24-12-13-27-28(15-24)42-19-41-27)20(3)34(32(36)31-26(33(37)38)16-29(35)43-31)18-21-10-11-22-8-6-7-9-23(22)14-21/h6-15,20,25-26,30-31H,4-5,16-19H2,1-3H3,(H,37,38)/p-1