2-cyanoethyl 4-(furan-3-yl)-2,6-dimethyl-5-[[(E)-3-phenylprop-2-enyl]carbamoyl]-1,4-dihydropyridine-3-carboxylate

Systemtic Name: 2-cyanoethyl 4-(furan-3-yl)-2,6-dimethyl-5-[[(E)-3-phenylprop-2-enyl]carbamoyl]-1,4-dihydropyridine-3-carboxylate Openeye Name: 2-cyanoethyl 5-[[(E)-cinnamyl]carbamoyl]-4-(3-furyl)-2,6-dimethyl-1,4-dihydropyridine-3-carboxylate CAS Name: 4-(3-furanyl)-2,6-dimethyl-5-[oxo-[[(E)-3-phenylprop-2-enyl]amino]methyl]-1,4-dihydropyridine-3-carboxylic acid 2-cyanoethyl ester IUPAC Name: 2-cyanoethyl 4-(furan-3-yl)-2,6-dimethyl-5-[[(E)-3-phenylprop-2-enyl]carbamoyl]-1,4-dihydropyridine-3-carboxylate Traditional Name: 5-[[(E)-cinnamyl]carbamoyl]-4-(3-furyl)-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid 2-cyanoethyl ester Formula: C25H25N3O4 MolecularWeight: 431.4837

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)OCCC#N)C2=COC=C2)C(=O)NCC=CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)OCCC#N)C2=COC=C2)C(=O)NC/C=C/C3=CC=CC=C3

InChI

InChI=1S/C25H25N3O4/c1-17-21(24(29)27-13-6-10-19-8-4-3-5-9-19)23(20-11-15-31-16-20)22(18(2)28-17)25(30)32-14-7-12-26/h3-6,8-11,15-16,23,28H,7,13-14H2,1-2H3,(H,27,29)/b10-6+