N-[(4-phenoxyphenyl)methyl]-N-propyl-2,3-bis(1,2,3,4-tetrazol-1-ylmethyl)cyclobutane-1-carboxamide

Systemtic Name: N-[(4-phenoxyphenyl)methyl]-N-propyl-2,3-bis(1,2,3,4-tetrazol-1-ylmethyl)cyclobutane-1-carboxamide Openeye Name: N-[(4-phenoxyphenyl)methyl]-N-propyl-2,3-bis(tetrazol-1-ylmethyl)cyclobutanecarboxamide CAS Name: N-[(4-phenoxyphenyl)methyl]-N-propyl-2,3-bis(1-tetrazolylmethyl)-1-cyclobutanecarboxamide IUPAC Name: N-[(4-phenoxyphenyl)methyl]-N-propyl-2,3-bis(tetrazol-1-ylmethyl)cyclobutane-1-carboxamide Traditional Name: N-(4-phenoxybenzyl)-N-propyl-2,3-bis(tetrazol-1-ylmethyl)cyclobutanecarboxamide Formula: C25H29N9O2 MolecularWeight: 487.55686

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC=C(C=C1)OC2=CC=CC=C2)C(=O)C3CC(C3CN4C=NN=N4)CN5C=NN=N5

Isomeric SMILES

CCCN(CC1=CC=C(C=C1)OC2=CC=CC=C2)C(=O)C3CC(C3CN4C=NN=N4)CN5C=NN=N5

InChI

InChI=1S/C25H29N9O2/c1-2-12-32(14-19-8-10-22(11-9-19)36-21-6-4-3-5-7-21)25(35)23-13-20(15-33-17-26-28-30-33)24(23)16-34-18-27-29-31-34/h3-11,17-18,20,23-24H,2,12-16H2,1H3