2-[4-[(4-propan-2-yloxyphenyl)methyl]piperazin-1-yl]ethyl 4-(2-oxidanylidene-3H-benzimidazol-1-yl)-3,6-dihydro-2H-pyridine-1-carboxylate

Systemtic Name: 2-[4-[(4-propan-2-yloxyphenyl)methyl]piperazin-1-yl]ethyl 4-(2-oxidanylidene-3H-benzimidazol-1-yl)-3,6-dihydro-2H-pyridine-1-carboxylate Openeye Name: 2-[4-[(4-isopropoxyphenyl)methyl]piperazin-1-yl]ethyl 4-(2-oxo-3H-benzimidazol-1-yl)-3,6-dihydro-2H-pyridine-1-carboxylate CAS Name: 4-(2-oxo-3H-benzimidazol-1-yl)-3,6-dihydro-2H-pyridine-1-carboxylic acid 2-[4-[(4-propan-2-yloxyphenyl)methyl]-1-piperazinyl]ethyl ester IUPAC Name: 2-[4-[(4-propan-2-yloxyphenyl)methyl]piperazin-1-yl]ethyl 4-(2-oxo-3H-benzimidazol-1-yl)-3,6-dihydro-2H-pyridine-1-carboxylate Traditional Name: 4-(2-keto-3H-benzimidazol-1-yl)-3,6-dihydro-2H-pyridine-1-carboxylic acid 2-[4-(4-isopropoxybenzyl)piperazino]ethyl ester Formula: C29H37N5O4 MolecularWeight: 519.63518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)CN2CCN(CC2)CCOC(=O)N3CCC(=CC3)N4C5=CC=CC=C5NC4=O

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)CN2CCN(CC2)CCOC(=O)N3CCC(=CC3)N4C5=CC=CC=C5NC4=O

InChI

InChI=1S/C29H37N5O4/c1-22(2)38-25-9-7-23(8-10-25)21-32-17-15-31(16-18-32)19-20-37-29(36)33-13-11-24(12-14-33)34-27-6-4-3-5-26(27)30-28(34)35/h3-11,22H,12-21H2,1-2H3,(H,30,35)