dimethyl 1-(1-adamantylmethyl)-4-(4-ethoxy-3-methoxy-phenyl)-4H-pyridine-3,5-dicarboxylate

Systemtic Name: dimethyl 1-(1-adamantylmethyl)-4-(4-ethoxy-3-methoxy-phenyl)-4H-pyridine-3,5-dicarboxylate Openeye Name: dimethyl 1-(1-adamantylmethyl)-4-(4-ethoxy-3-methoxy-phenyl)-4H-pyridine-3,5-dicarboxylate CAS Name: 1-(1-adamantylmethyl)-4-(4-ethoxy-3-methoxyphenyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 1-(1-adamantylmethyl)-4-(4-ethoxy-3-methoxyphenyl)-4H-pyridine-3,5-dicarboxylate Traditional Name: 1-(1-adamantylmethyl)-4-(4-ethoxy-3-methoxy-phenyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester Formula: C29H37NO6 MolecularWeight: 495.60718

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2C(=CN(C=C2C(=O)OC)CC34CC5CC(C3)CC(C5)C4)C(=O)OC)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2C(=CN(C=C2C(=O)OC)CC34CC5CC(C3)CC(C5)C4)C(=O)OC)OC

InChI

InChI=1S/C29H37NO6/c1-5-36-24-7-6-21(11-25(24)33-2)26-22(27(31)34-3)15-30(16-23(26)28(32)35-4)17-29-12-18-8-19(13-29)10-20(9-18)14-29/h6-7,11,15-16,18-20,26H,5,8-10,12-14,17H2,1-4H3