butyl-[(2R)-3,4-dimethyl-5-oxidanylidene-1-[(2R)-4-phenylbutan-2-yl]-2H-pyrrol-2-yl]azanium

Systemtic Name: butyl-[(2R)-3,4-dimethyl-5-oxidanylidene-1-[(2R)-4-phenylbutan-2-yl]-2H-pyrrol-2-yl]azanium Openeye Name: butyl-[(2R)-3,4-dimethyl-1-[(1R)-1-methyl-3-phenyl-propyl]-5-oxo-2H-pyrrol-2-yl]ammonium CAS Name: butyl-[(2R)-3,4-dimethyl-5-oxo-1-[(2R)-4-phenylbutan-2-yl]-2H-pyrrol-2-yl]ammonium IUPAC Name: butyl-[(2R)-3,4-dimethyl-5-oxo-1-[(2R)-4-phenylbutan-2-yl]-2H-pyrrol-2-yl]azanium Traditional Name: butyl-[(2R)-5-keto-3,4-dimethyl-1-[(1R)-1-methyl-3-phenyl-propyl]-3-pyrrolin-2-yl]ammonium Formula: C20H31N2O+ MolecularWeight: 315.47294

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH2+]C1C(=C(C(=O)N1C(C)CCC2=CC=CC=C2)C)C

Isomeric SMILES

CCCC[NH2+][C@H]1C(=C(C(=O)N1[C@H](C)CCC2=CC=CC=C2)C)C

InChI

InChI=1S/C20H30N2O/c1-5-6-14-21-19-16(3)17(4)20(23)22(19)15(2)12-13-18-10-8-7-9-11-18/h7-11,15,19,21H,5-6,12-14H2,1-4H3/p+1/t15-,19-/m1/s1