3-cyanopropyl 3-(1-adamantylcarbamoylamino)propanoate

Systemtic Name: 3-cyanopropyl 3-(1-adamantylcarbamoylamino)propanoate Openeye Name: 3-cyanopropyl 3-(1-adamantylcarbamoylamino)propanoate CAS Name: 3-[[(1-adamantylamino)-oxomethyl]amino]propanoic acid 3-cyanopropyl ester IUPAC Name: 3-cyanopropyl 3-(1-adamantylcarbamoylamino)propanoate Traditional Name: 3-(1-adamantylcarbamoylamino)propionic acid 3-cyanopropyl ester Formula: C18H27N3O3 MolecularWeight: 333.42528

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)NCCC(=O)OCCCC#N

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)NCCC(=O)OCCCC#N

InChI

InChI=1S/C18H27N3O3/c19-4-1-2-6-24-16(22)3-5-20-17(23)21-18-10-13-7-14(11-18)9-15(8-13)12-18/h13-15H,1-3,5-12H2,(H2,20,21,23)