O3-(6-nitrooxyhexyl) O5-propan-2-yl 2-azanyl-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O3-(6-nitrooxyhexyl) O5-propan-2-yl 2-azanyl-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O5-isopropyl O3-(6-nitrooxyhexyl) 2-amino-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2-amino-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O3-(6-nitrooxyhexyl) ester O5-propan-2-yl ester IUPAC Name: 3-O-(6-nitrooxyhexyl) 5-O-propan-2-yl 2-amino-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2-amino-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O5-isopropyl ester O3-(6-nitrooxyhexyl) ester Formula: C23H30N4O9 MolecularWeight: 506.5057

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)N)C(=O)OCCCCCCO[N+](=O)[O-])C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC(C)C

Isomeric SMILES

CC1=C(C(C(=C(N1)N)C(=O)OCCCCCCO[N+](=O)[O-])C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC(C)C

InChI

InChI=1S/C23H30N4O9/c1-14(2)36-23(29)18-15(3)25-21(24)20(19(18)16-9-8-10-17(13-16)26(30)31)22(28)34-11-6-4-5-7-12-35-27(32)33/h8-10,13-14,19,25H,4-7,11-12,24H2,1-3H3