2-phenoxyethyl 2,6-dimethyl-4-(3-nitrophenyl)-5-pyridin-4-yl-1,4-dihydropyridine-3-carboxylate

Systemtic Name: 2-phenoxyethyl 2,6-dimethyl-4-(3-nitrophenyl)-5-pyridin-4-yl-1,4-dihydropyridine-3-carboxylate Openeye Name: 2-phenoxyethyl 2,6-dimethyl-4-(3-nitrophenyl)-5-(4-pyridyl)-1,4-dihydropyridine-3-carboxylate CAS Name: 2,6-dimethyl-4-(3-nitrophenyl)-5-pyridin-4-yl-1,4-dihydropyridine-3-carboxylic acid 2-phenoxyethyl ester IUPAC Name: 2-phenoxyethyl 2,6-dimethyl-4-(3-nitrophenyl)-5-pyridin-4-yl-1,4-dihydropyridine-3-carboxylate Traditional Name: 2,6-dimethyl-4-(3-nitrophenyl)-5-(4-pyridyl)-1,4-dihydropyridine-3-carboxylic acid 2-phenoxyethyl ester Formula: C27H25N3O5 MolecularWeight: 471.5045

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)OCCOC2=CC=CC=C2)C3=CC(=CC=C3)[N+](=O)[O-])C4=CC=NC=C4

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)OCCOC2=CC=CC=C2)C3=CC(=CC=C3)[N+](=O)[O-])C4=CC=NC=C4

InChI

InChI=1S/C27H25N3O5/c1-18-24(20-11-13-28-14-12-20)26(21-7-6-8-22(17-21)30(32)33)25(19(2)29-18)27(31)35-16-15-34-23-9-4-3-5-10-23/h3-14,17,26,29H,15-16H2,1-2H3