1-[4-(4-propylpiperazin-1-yl)-3-(3,3,5,5-tetramethylcyclohexyl)phenyl]azepane

Systemtic Name: 1-[4-(4-propylpiperazin-1-yl)-3-(3,3,5,5-tetramethylcyclohexyl)phenyl]azepane Openeye Name: 1-[4-(4-propylpiperazin-1-yl)-3-(3,3,5,5-tetramethylcyclohexyl)phenyl]azepane CAS Name: 1-[4-(4-propyl-1-piperazinyl)-3-(3,3,5,5-tetramethylcyclohexyl)phenyl]azepane IUPAC Name: 1-[4-(4-propylpiperazin-1-yl)-3-(3,3,5,5-tetramethylcyclohexyl)phenyl]azepane Traditional Name: 1-[4-(4-propylpiperazino)-3-(3,3,5,5-tetramethylcyclohexyl)phenyl]azepane Formula: C29H49N3 MolecularWeight: 439.71946

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCN(CC1)C2=C(C=C(C=C2)N3CCCCCC3)C4CC(CC(C4)(C)C)(C)C

Isomeric SMILES

CCCN1CCN(CC1)C2=C(C=C(C=C2)N3CCCCCC3)C4CC(CC(C4)(C)C)(C)C

InChI

InChI=1S/C29H49N3/c1-6-13-30-16-18-32(19-17-30)27-12-11-25(31-14-9-7-8-10-15-31)20-26(27)24-21-28(2,3)23-29(4,5)22-24/h11-12,20,24H,6-10,13-19,21-23H2,1-5H3