[(4S)-5-ethoxycarbonyl-4-ethyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidin-6-yl]methyl-[(1R)-1-naphthalen-1-ylethyl]azanium

Systemtic Name: [(4S)-5-ethoxycarbonyl-4-ethyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidin-6-yl]methyl-[(1R)-1-naphthalen-1-ylethyl]azanium Openeye Name: [(4S)-5-ethoxycarbonyl-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl]methyl-[(1R)-1-(1-naphthyl)ethyl]ammonium CAS Name: [(4S)-5-ethoxycarbonyl-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl]methyl-[(1R)-1-(1-naphthalenyl)ethyl]ammonium IUPAC Name: [(4S)-5-ethoxycarbonyl-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl]methyl-[(1R)-1-naphthalen-1-ylethyl]azanium Traditional Name: [(4S)-5-carbethoxy-4-ethyl-2-keto-3,4-dihydro-1H-pyrimidin-6-yl]methyl-[(1R)-1-(1-naphthyl)ethyl]ammonium Formula: C22H28N3O3+ MolecularWeight: 382.47602

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=C(NC(=O)N1)C[NH2+]C(C)C2=CC=CC3=CC=CC=C32)C(=O)OCC

Isomeric SMILES

CC[C@H]1C(=C(NC(=O)N1)C[NH2+][C@H](C)C2=CC=CC3=CC=CC=C32)C(=O)OCC

InChI

InChI=1S/C22H27N3O3/c1-4-18-20(21(26)28-5-2)19(25-22(27)24-18)13-23-14(3)16-12-8-10-15-9-6-7-11-17(15)16/h6-12,14,18,23H,4-5,13H2,1-3H3,(H2,24,25,27)/p+1/t14-,18+/m1/s1