methyl 4-[[(2R)-1-(1-adamantylcarbonyl)pyrrolidin-2-yl]carbonylamino]benzoate

Systemtic Name: methyl 4-[[(2R)-1-(1-adamantylcarbonyl)pyrrolidin-2-yl]carbonylamino]benzoate Openeye Name: methyl 4-[[(2R)-1-(adamantane-1-carbonyl)pyrrolidine-2-carbonyl]amino]benzoate CAS Name: 4-[[[(2R)-1-[1-adamantyl(oxo)methyl]-2-pyrrolidinyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[(2R)-1-(adamantane-1-carbonyl)pyrrolidine-2-carbonyl]amino]benzoate Traditional Name: 4-[[(2R)-1-(adamantane-1-carbonyl)prolyl]amino]benzoic acid methyl ester Formula: C24H30N2O4 MolecularWeight: 410.506

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)C2CCCN2C(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)[C@H]2CCCN2C(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C24H30N2O4/c1-30-22(28)18-4-6-19(7-5-18)25-21(27)20-3-2-8-26(20)23(29)24-12-15-9-16(13-24)11-17(10-15)14-24/h4-7,15-17,20H,2-3,8-14H2,1H3,(H,25,27)/t15?,16?,17?,20-,24?/m1/s1