O5-(2-nitrooxyethyl) O3-(3-nitrooxypropyl) 2-azanyl-6-methyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O5-(2-nitrooxyethyl) O3-(3-nitrooxypropyl) 2-azanyl-6-methyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O5-(2-nitrooxyethyl) O3-(3-nitrooxypropyl) 2-amino-6-methyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2-amino-6-methyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O5-(2-nitrooxyethyl) ester O3-(3-nitrooxypropyl) ester IUPAC Name: 5-O-(2-nitrooxyethyl) 3-O-(3-nitrooxypropyl) 2-amino-6-methyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2-amino-6-methyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O5-(2-nitrooxyethyl) ester O3-(3-nitrooxypropyl) ester Formula: C19H21N5O12 MolecularWeight: 511.39634

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21N5O12/c1-11-14(18(25)34-9-10-36-24(31)32)15(12-5-2-3-6-13(12)22(27)28)16(17(20)21-11)19(26)33-7-4-8-35-23(29)30/h2-3,5-6,15,21H,4,7-10,20H2,1H3