methyl (2S)-2-(1-adamantyl)-2-(propylcarbamoylamino)ethanoate

Systemtic Name: methyl (2S)-2-(1-adamantyl)-2-(propylcarbamoylamino)ethanoate Openeye Name: methyl (2S)-2-(1-adamantyl)-2-(propylcarbamoylamino)acetate CAS Name: (2S)-2-(1-adamantyl)-2-[[oxo(propylamino)methyl]amino]acetic acid methyl ester IUPAC Name: methyl (2S)-2-(1-adamantyl)-2-(propylcarbamoylamino)acetate Traditional Name: (2S)-2-(1-adamantyl)-2-(propylcarbamoylamino)acetic acid methyl ester Formula: C17H28N2O3 MolecularWeight: 308.41582

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)NC(C(=O)OC)C12CC3CC(C1)CC(C3)C2

Isomeric SMILES

CCCNC(=O)N[C@H](C(=O)OC)C12CC3CC(C1)CC(C3)C2

InChI

InChI=1S/C17H28N2O3/c1-3-4-18-16(21)19-14(15(20)22-2)17-8-11-5-12(9-17)7-13(6-11)10-17/h11-14H,3-10H2,1-2H3,(H2,18,19,21)/t11?,12?,13?,14-,17?/m1/s1