2-[1-adamantyl(2-azanylpropanoyl)amino]-5-azanyl-5-oxidanylidene-pentanoic acid

Systemtic Name: 2-[1-adamantyl(2-azanylpropanoyl)amino]-5-azanyl-5-oxidanylidene-pentanoic acid Openeye Name: 2-[1-adamantyl(2-aminopropanoyl)amino]-5-amino-5-oxo-pentanoic acid CAS Name: 2-[1-adamantyl-(2-amino-1-oxopropyl)amino]-5-amino-5-oxopentanoic acid IUPAC Name: 2-[1-adamantyl(2-aminopropanoyl)amino]-5-amino-5-oxopentanoic acid Traditional Name: 2-[1-adamantyl(alanyl)amino]-5-amino-5-keto-valeric acid Formula: C18H29N3O4 MolecularWeight: 351.44056

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C(CCC(=O)N)C(=O)O)C12CC3CC(C1)CC(C3)C2)N

Isomeric SMILES

CC(C(=O)N(C(CCC(=O)N)C(=O)O)C12CC3CC(C1)CC(C3)C2)N

InChI

InChI=1S/C18H29N3O4/c1-10(19)16(23)21(14(17(24)25)2-3-15(20)22)18-7-11-4-12(8-18)6-13(5-11)9-18/h10-14H,2-9,19H2,1H3,(H2,20,22)(H,24,25)