O3-(2-nitrooxyethyl) O5-(phenylmethyl) 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O3-(2-nitrooxyethyl) O5-(phenylmethyl) 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O5-benzyl O3-(2-nitrooxyethyl) 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O3-(2-nitrooxyethyl) ester O5-(phenylmethyl) ester IUPAC Name: 5-O-benzyl 3-O-(2-nitrooxyethyl) 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O5-benzyl ester O3-(2-nitrooxyethyl) ester Formula: C24H23N3O9 MolecularWeight: 497.45412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)OCC2=CC=CC=C2)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)OCCO[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)OCC2=CC=CC=C2)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)OCCO[N+](=O)[O-]

InChI

InChI=1S/C24H23N3O9/c1-15-20(23(28)34-11-12-36-27(32)33)22(18-9-6-10-19(13-18)26(30)31)21(16(2)25-15)24(29)35-14-17-7-4-3-5-8-17/h3-10,13,22,25H,11-12,14H2,1-2H3