(phenylmethyl) (2R)-1-[3-(1-adamantylmethylcarbamoyl)naphthalen-2-yl]carbonylpyrrolidine-2-carboxylate

Systemtic Name: (phenylmethyl) (2R)-1-[3-(1-adamantylmethylcarbamoyl)naphthalen-2-yl]carbonylpyrrolidine-2-carboxylate Openeye Name: benzyl (2R)-1-[3-(1-adamantylmethylcarbamoyl)naphthalene-2-carbonyl]pyrrolidine-2-carboxylate CAS Name: (2R)-1-[[3-[(1-adamantylmethylamino)-oxomethyl]-2-naphthalenyl]-oxomethyl]-2-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2R)-1-[3-(1-adamantylmethylcarbamoyl)naphthalene-2-carbonyl]pyrrolidine-2-carboxylate Traditional Name: (2R)-1-[3-(1-adamantylmethylcarbamoyl)-2-naphthoyl]pyrrolidine-2-carboxylic acid benzyl ester Formula: C35H38N2O4 MolecularWeight: 550.68722

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2=CC3=CC=CC=C3C=C2C(=O)NCC45CC6CC(C4)CC(C6)C5)C(=O)OCC7=CC=CC=C7

Isomeric SMILES

C1C[C@@H](N(C1)C(=O)C2=CC3=CC=CC=C3C=C2C(=O)NCC45CC6CC(C4)CC(C6)C5)C(=O)OCC7=CC=CC=C7

InChI

InChI=1S/C35H38N2O4/c38-32(36-22-35-18-24-13-25(19-35)15-26(14-24)20-35)29-16-27-9-4-5-10-28(27)17-30(29)33(39)37-12-6-11-31(37)34(40)41-21-23-7-2-1-3-8-23/h1-5,7-10,16-17,24-26,31H,6,11-15,18-22H2,(H,36,38)/t24?,25?,26?,31-,35?/m1/s1