2-[4-[(4-acetamidophenyl)methyl]piperazin-1-yl]ethyl 4-(phenylmethyl)piperazine-1-carboxylate

Systemtic Name: 2-[4-[(4-acetamidophenyl)methyl]piperazin-1-yl]ethyl 4-(phenylmethyl)piperazine-1-carboxylate Openeye Name: 2-[4-[(4-acetamidophenyl)methyl]piperazin-1-yl]ethyl 4-benzylpiperazine-1-carboxylate CAS Name: 4-(phenylmethyl)-1-piperazinecarboxylic acid 2-[4-[(4-acetamidophenyl)methyl]-1-piperazinyl]ethyl ester IUPAC Name: 2-[4-[(4-acetamidophenyl)methyl]piperazin-1-yl]ethyl 4-benzylpiperazine-1-carboxylate Traditional Name: 4-benzylpiperazine-1-carboxylic acid 2-[4-(4-acetamidobenzyl)piperazino]ethyl ester Formula: C27H37N5O3 MolecularWeight: 479.61438

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)CN2CCN(CC2)CCOC(=O)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)CN2CCN(CC2)CCOC(=O)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C27H37N5O3/c1-23(33)28-26-9-7-25(8-10-26)22-30-13-11-29(12-14-30)19-20-35-27(34)32-17-15-31(16-18-32)21-24-5-3-2-4-6-24/h2-10H,11-22H2,1H3,(H,28,33)