(4-butoxy-3-methoxy-phenyl)-[4-(1-phenyl-1,2,3,4-tetrazol-5-yl)piperazin-1-yl]methanone

Systemtic Name: (4-butoxy-3-methoxy-phenyl)-[4-(1-phenyl-1,2,3,4-tetrazol-5-yl)piperazin-1-yl]methanone Openeye Name: (4-butoxy-3-methoxy-phenyl)-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]methanone CAS Name: (4-butoxy-3-methoxyphenyl)-[4-(1-phenyl-5-tetrazolyl)-1-piperazinyl]methanone IUPAC Name: (4-butoxy-3-methoxyphenyl)-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]methanone Traditional Name: (4-butoxy-3-methoxy-phenyl)-[4-(1-phenyltetrazol-5-yl)piperazino]methanone Formula: C23H28N6O3 MolecularWeight: 436.50682

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=NN=NN3C4=CC=CC=C4)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=NN=NN3C4=CC=CC=C4)OC

InChI

InChI=1S/C23H28N6O3/c1-3-4-16-32-20-11-10-18(17-21(20)31-2)22(30)27-12-14-28(15-13-27)23-24-25-26-29(23)19-8-6-5-7-9-19/h5-11,17H,3-4,12-16H2,1-2H3