(2R)-2-(1-adamantylcarbamoylamino)-3-phenyl-propanoic acid

Systemtic Name: (2R)-2-(1-adamantylcarbamoylamino)-3-phenyl-propanoic acid Openeye Name: (2R)-2-(1-adamantylcarbamoylamino)-3-phenyl-propanoic acid CAS Name: (2R)-2-[[(1-adamantylamino)-oxomethyl]amino]-3-phenylpropanoic acid IUPAC Name: (2R)-2-(1-adamantylcarbamoylamino)-3-phenylpropanoic acid Traditional Name: (2R)-2-(1-adamantylcarbamoylamino)-3-phenyl-propionic acid Formula: C20H26N2O3 MolecularWeight: 342.43204

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)NC(CC4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)N[C@H](CC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C20H26N2O3/c23-18(24)17(9-13-4-2-1-3-5-13)21-19(25)22-20-10-14-6-15(11-20)8-16(7-14)12-20/h1-5,14-17H,6-12H2,(H,23,24)(H2,21,22,25)/t14?,15?,16?,17-,20?/m1/s1