[(R)-(4-methylphenyl)-phenyl-methyl]-[2-oxidanylidene-2-(pentan-3-ylamino)ethyl]azanium

Systemtic Name: [(R)-(4-methylphenyl)-phenyl-methyl]-[2-oxidanylidene-2-(pentan-3-ylamino)ethyl]azanium Openeye Name: [2-(1-ethylpropylamino)-2-oxo-ethyl]-[(R)-phenyl(p-tolyl)methyl]ammonium CAS Name: [(R)-(4-methylphenyl)-phenylmethyl]-[2-oxo-2-(pentan-3-ylamino)ethyl]ammonium IUPAC Name: [(R)-(4-methylphenyl)-phenylmethyl]-[2-oxo-2-(pentan-3-ylamino)ethyl]azanium Traditional Name: [2-(1-ethylpropylamino)-2-keto-ethyl]-[(R)-phenyl(p-tolyl)methyl]ammonium Formula: C21H29N2O+ MolecularWeight: 325.46776

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)C[NH2+]C(C1=CC=CC=C1)C2=CC=C(C=C2)C

Isomeric SMILES

CCC(CC)NC(=O)C[NH2+][C@H](C1=CC=CC=C1)C2=CC=C(C=C2)C

InChI

InChI=1S/C21H28N2O/c1-4-19(5-2)23-20(24)15-22-21(17-9-7-6-8-10-17)18-13-11-16(3)12-14-18/h6-14,19,21-22H,4-5,15H2,1-3H3,(H,23,24)/p+1/t21-/m1/s1