O5-ethyl O3-(2-phenylmethoxyethyl) 2-(hydroxymethyl)-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O5-ethyl O3-(2-phenylmethoxyethyl) 2-(hydroxymethyl)-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O3-(2-benzyloxyethyl) O5-ethyl 2-(hydroxymethyl)-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2-(hydroxymethyl)-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O5-ethyl ester O3-(2-phenylmethoxyethyl) ester IUPAC Name: 5-O-ethyl 3-O-(2-phenylmethoxyethyl) 2-(hydroxymethyl)-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2-methyl-6-methylol-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O5-(2-benzoxyethyl) ester O3-ethyl ester Formula: C26H28N2O8 MolecularWeight: 496.50912

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCCOCC3=CC=CC=C3)CO)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCCOCC3=CC=CC=C3)CO)C

InChI

InChI=1S/C26H28N2O8/c1-3-35-25(30)22-17(2)27-21(15-29)24(23(22)19-10-7-11-20(14-19)28(32)33)26(31)36-13-12-34-16-18-8-5-4-6-9-18/h4-11,14,23,27,29H,3,12-13,15-16H2,1-2H3