[(1R)-1-(1-adamantyl)ethyl]-[(2R)-1-oxidanylidene-1-phenylazanyl-propan-2-yl]azanium

Systemtic Name: [(1R)-1-(1-adamantyl)ethyl]-[(2R)-1-oxidanylidene-1-phenylazanyl-propan-2-yl]azanium Openeye Name: [(1R)-1-(1-adamantyl)ethyl]-[(1R)-2-anilino-1-methyl-2-oxo-ethyl]ammonium CAS Name: [(1R)-1-(1-adamantyl)ethyl]-[(2R)-1-anilino-1-oxopropan-2-yl]ammonium IUPAC Name: [(1R)-1-(1-adamantyl)ethyl]-[(2R)-1-anilino-1-oxopropan-2-yl]azanium Traditional Name: [(1R)-1-(1-adamantyl)ethyl]-[(1R)-2-anilino-2-keto-1-methyl-ethyl]ammonium Formula: C21H31N2O+ MolecularWeight: 327.48364

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1)[NH2+]C(C)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1)[NH2+][C@H](C)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C21H30N2O/c1-14(20(24)23-19-6-4-3-5-7-19)22-15(2)21-11-16-8-17(12-21)10-18(9-16)13-21/h3-7,14-18,22H,8-13H2,1-2H3,(H,23,24)/p+1/t14-,15-,16?,17?,18?,21?/m1/s1