N-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide

Systemtic Name: N-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide Openeye Name: N-[4-(4-benzylpiperazin-1-yl)phenyl]tetralin-1-carboxamide CAS Name: N-[4-[4-(phenylmethyl)-1-piperazinyl]phenyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide IUPAC Name: N-[4-(4-benzylpiperazin-1-yl)phenyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide Traditional Name: N-[4-(4-benzylpiperazino)phenyl]tetralin-1-carboxamide Formula: C28H31N3O MolecularWeight: 425.56524

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=CC=CC=C2C1)C(=O)NC3=CC=C(C=C3)N4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

C1CC(C2=CC=CC=C2C1)C(=O)NC3=CC=C(C=C3)N4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C28H31N3O/c32-28(27-12-6-10-23-9-4-5-11-26(23)27)29-24-13-15-25(16-14-24)31-19-17-30(18-20-31)21-22-7-2-1-3-8-22/h1-5,7-9,11,13-16,27H,6,10,12,17-21H2,(H,29,32)