3-[[(2R)-1-[(4-acetamidophenyl)amino]-1-oxidanylidene-propan-2-yl]azaniumyl]propyl-diethyl-azanium

Systemtic Name: 3-[[(2R)-1-[(4-acetamidophenyl)amino]-1-oxidanylidene-propan-2-yl]azaniumyl]propyl-diethyl-azanium Openeye Name: 3-[[(1R)-2-(4-acetamidoanilino)-1-methyl-2-oxo-ethyl]ammonio]propyl-diethyl-ammonium CAS Name: 3-[[(2R)-1-(4-acetamidoanilino)-1-oxopropan-2-yl]ammonio]propyl-diethylammonium IUPAC Name: 3-[[(2R)-1-(4-acetamidoanilino)-1-oxopropan-2-yl]azaniumyl]propyl-diethylazanium Traditional Name: 3-[[(1R)-2-(4-acetamidoanilino)-2-keto-1-methyl-ethyl]ammonio]propyl-diethyl-ammonium Formula: C18H32N4O2+2 MolecularWeight: 336.47228

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCC[NH2+]C(C)C(=O)NC1=CC=C(C=C1)NC(=O)C

Isomeric SMILES

CC[NH+](CC)CCC[NH2+][C@H](C)C(=O)NC1=CC=C(C=C1)NC(=O)C

InChI

InChI=1S/C18H30N4O2/c1-5-22(6-2)13-7-12-19-14(3)18(24)21-17-10-8-16(9-11-17)20-15(4)23/h8-11,14,19H,5-7,12-13H2,1-4H3,(H,20,23)(H,21,24)/p+2/t14-/m1/s1