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

Systemtic Name: [[3-(1,3-benzodioxol-5-yl)-5,5-diethoxy-pentan-2-yl]-(naphthalen-2-ylmethyl)carbamoyl] 5-oxidanylideneoxolane-3-carboxylate Openeye Name: [[2-(1,3-benzodioxol-5-yl)-4,4-diethoxy-1-methyl-butyl]-(2-naphthylmethyl)carbamoyl] 5-oxotetrahydrofuran-3-carboxylate CAS Name: 5-oxo-3-oxolanecarboxylic acid [[[3-(1,3-benzodioxol-5-yl)-5,5-diethoxypentan-2-yl]-(2-naphthalenylmethyl)amino]-oxomethyl] ester IUPAC Name: [[3-(1,3-benzodioxol-5-yl)-5,5-diethoxypentan-2-yl]-(naphthalen-2-ylmethyl)carbamoyl] 5-oxooxolane-3-carboxylate Traditional Name: 5-ketotetrahydrofuran-3-carboxylic acid [[2-(1,3-benzodioxol-5-yl)-4,4-diethoxy-1-methyl-butyl]-(2-naphthylmethyl)carbamoyl] ester Formula: C33H37NO9 MolecularWeight: 591.64818

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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)OC(=O)C5CC(=O)OC5)OCC

Isomeric SMILES

CCOC(CC(C1=CC2=C(C=C1)OCO2)C(C)N(CC3=CC4=CC=CC=C4C=C3)C(=O)OC(=O)C5CC(=O)OC5)OCC

InChI

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