(2R)-1-[3-(1-adamantylmethylcarbamoyl)naphthalen-2-yl]carbonylpyrrolidine-2-carboxylic acid

Systemtic Name: (2R)-1-[3-(1-adamantylmethylcarbamoyl)naphthalen-2-yl]carbonylpyrrolidine-2-carboxylic acid Openeye Name: (2R)-1-[3-(1-adamantylmethylcarbamoyl)naphthalene-2-carbonyl]pyrrolidine-2-carboxylic acid CAS Name: (2R)-1-[[3-[(1-adamantylmethylamino)-oxomethyl]-2-naphthalenyl]-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2R)-1-[3-(1-adamantylmethylcarbamoyl)naphthalene-2-carbonyl]pyrrolidine-2-carboxylic acid Traditional Name: (2R)-1-[3-(1-adamantylmethylcarbamoyl)-2-naphthoyl]proline Formula: C28H32N2O4 MolecularWeight: 460.56468

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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)O

Isomeric SMILES

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

InChI

InChI=1S/C28H32N2O4/c31-25(29-16-28-13-17-8-18(14-28)10-19(9-17)15-28)22-11-20-4-1-2-5-21(20)12-23(22)26(32)30-7-3-6-24(30)27(33)34/h1-2,4-5,11-12,17-19,24H,3,6-10,13-16H2,(H,29,31)(H,33,34)/t17?,18?,19?,24-,28?/m1/s1