methyl 5-[[4-[(4-cyanophenyl)methyl]piperazin-1-yl]methyl]-3-methyl-furan-2-carboxylate

Systemtic Name: methyl 5-[[4-[(4-cyanophenyl)methyl]piperazin-1-yl]methyl]-3-methyl-furan-2-carboxylate Openeye Name: methyl 5-[[4-[(4-cyanophenyl)methyl]piperazin-1-yl]methyl]-3-methyl-furan-2-carboxylate CAS Name: 5-[[4-[(4-cyanophenyl)methyl]-1-piperazinyl]methyl]-3-methyl-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[4-[(4-cyanophenyl)methyl]piperazin-1-yl]methyl]-3-methylfuran-2-carboxylate Traditional Name: 5-[[4-(4-cyanobenzyl)piperazino]methyl]-3-methyl-furan-2-carboxylic acid methyl ester Formula: C20H23N3O3 MolecularWeight: 353.41492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=C1)CN2CCN(CC2)CC3=CC=C(C=C3)C#N)C(=O)OC

Isomeric SMILES

CC1=C(OC(=C1)CN2CCN(CC2)CC3=CC=C(C=C3)C#N)C(=O)OC

InChI

InChI=1S/C20H23N3O3/c1-15-11-18(26-19(15)20(24)25-2)14-23-9-7-22(8-10-23)13-17-5-3-16(12-21)4-6-17/h3-6,11H,7-10,13-14H2,1-2H3