6-azanyl-5-[2-[(2S)-2-phenylpyrrolidin-1-ium-1-yl]ethanoyl]-1-propyl-pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-5-[2-[(2S)-2-phenylpyrrolidin-1-ium-1-yl]ethanoyl]-1-propyl-pyrimidine-2,4-dione Openeye Name: 6-amino-5-[2-[(2S)-2-phenylpyrrolidin-1-ium-1-yl]acetyl]-1-propyl-pyrimidine-2,4-dione CAS Name: 6-amino-5-[1-oxo-2-[(2S)-2-phenyl-1-pyrrolidin-1-iumyl]ethyl]-1-propylpyrimidine-2,4-dione IUPAC Name: 6-amino-5-[2-[(2S)-2-phenylpyrrolidin-1-ium-1-yl]acetyl]-1-propylpyrimidine-2,4-dione Traditional Name: 6-amino-5-[2-[(2S)-2-phenylpyrrolidin-1-ium-1-yl]acetyl]-1-propyl-pyrimidine-2,4-quinone Formula: C19H25N4O3+ MolecularWeight: 357.4268

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(=O)NC1=O)C(=O)C[NH+]2CCCC2C3=CC=CC=C3)N

Isomeric SMILES

CCCN1C(=C(C(=O)NC1=O)C(=O)C[NH+]2CCC[C@H]2C3=CC=CC=C3)N

InChI

InChI=1S/C19H24N4O3/c1-2-10-23-17(20)16(18(25)21-19(23)26)15(24)12-22-11-6-9-14(22)13-7-4-3-5-8-13/h3-5,7-8,14H,2,6,9-12,20H2,1H3,(H,21,25,26)/p+1/t14-/m0/s1