2,2-dimethyl-6-[4-(4-nitrophenyl)piperazin-1-yl]-3-phenyl-hex-4-yn-3-ol

Systemtic Name: 2,2-dimethyl-6-[4-(4-nitrophenyl)piperazin-1-yl]-3-phenyl-hex-4-yn-3-ol Openeye Name: 2,2-dimethyl-6-[4-(4-nitrophenyl)piperazin-1-yl]-3-phenyl-hex-4-yn-3-ol CAS Name: 2,2-dimethyl-6-[4-(4-nitrophenyl)-1-piperazinyl]-3-phenyl-4-hexyn-3-ol IUPAC Name: 2,2-dimethyl-6-[4-(4-nitrophenyl)piperazin-1-yl]-3-phenylhex-4-yn-3-ol Traditional Name: 2,2-dimethyl-6-[4-(4-nitrophenyl)piperazino]-3-phenyl-hex-4-yn-3-ol Formula: C24H29N3O3 MolecularWeight: 407.50536

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C#CCN1CCN(CC1)C2=CC=C(C=C2)[N+](=O)[O-])(C3=CC=CC=C3)O

Isomeric SMILES

CC(C)(C)C(C#CCN1CCN(CC1)C2=CC=C(C=C2)[N+](=O)[O-])(C3=CC=CC=C3)O

InChI

InChI=1S/C24H29N3O3/c1-23(2,3)24(28,20-8-5-4-6-9-20)14-7-15-25-16-18-26(19-17-25)21-10-12-22(13-11-21)27(29)30/h4-6,8-13,28H,15-19H2,1-3H3