2-[[5-methoxycarbonyl-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridin-3-yl]carbonylamino]propanoic acid

Systemtic Name: 2-[[5-methoxycarbonyl-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridin-3-yl]carbonylamino]propanoic acid Openeye Name: 2-[[5-methoxycarbonyl-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carbonyl]amino]propanoic acid CAS Name: 2-[[[5-methoxycarbonyl-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridin-3-yl]-oxomethyl]amino]propanoic acid IUPAC Name: 2-[[5-methoxycarbonyl-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carbonyl]amino]propanoic acid Traditional Name: 2-[[5-carbomethoxy-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carbonyl]amino]propionic acid Formula: C18H19N3O7 MolecularWeight: 389.35936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=CN1)C(=O)NC(C)C(=O)O)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C(C(C(=CN1)C(=O)NC(C)C(=O)O)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C18H19N3O7/c1-9-14(18(25)28-3)15(11-5-4-6-12(7-11)21(26)27)13(8-19-9)16(22)20-10(2)17(23)24/h4-8,10,15,19H,1-3H3,(H,20,22)(H,23,24)