ditert-butyl 4-(4-hexoxyphenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: ditert-butyl 4-(4-hexoxyphenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: ditert-butyl 4-(4-hexoxyphenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 4-(4-hexoxyphenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid ditert-butyl ester IUPAC Name: ditert-butyl 4-(4-hexoxyphenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 4-(4-hexoxyphenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid ditert-butyl ester Formula: C29H43NO5 MolecularWeight: 485.65542

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C2C(=C(NC(=C2C(=O)OC(C)(C)C)C)C)C(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C2C(=C(NC(=C2C(=O)OC(C)(C)C)C)C)C(=O)OC(C)(C)C

InChI

InChI=1S/C29H43NO5/c1-10-11-12-13-18-33-22-16-14-21(15-17-22)25-23(26(31)34-28(4,5)6)19(2)30-20(3)24(25)27(32)35-29(7,8)9/h14-17,25,30H,10-13,18H2,1-9H3