2-butyl-4-[3-[methyl(naphthalen-1-yl)amino]prop-1-ynyl]-4-oxidanyl-3-propan-2-yloxy-cyclobut-2-en-1-one

Systemtic Name: 2-butyl-4-[3-[methyl(naphthalen-1-yl)amino]prop-1-ynyl]-4-oxidanyl-3-propan-2-yloxy-cyclobut-2-en-1-one Openeye Name: 2-butyl-4-hydroxy-3-isopropoxy-4-[3-[methyl(1-naphthyl)amino]prop-1-ynyl]cyclobut-2-en-1-one CAS Name: 2-butyl-4-hydroxy-4-[3-[methyl(1-naphthalenyl)amino]prop-1-ynyl]-3-propan-2-yloxy-1-cyclobut-2-enone IUPAC Name: 2-butyl-4-hydroxy-4-[3-[methyl(naphthalen-1-yl)amino]prop-1-ynyl]-3-propan-2-yloxycyclobut-2-en-1-one Traditional Name: 2-butyl-4-hydroxy-3-isopropoxy-4-[3-[methyl(1-naphthyl)amino]prop-1-ynyl]cyclobut-2-en-1-one Formula: C25H29NO3 MolecularWeight: 391.50266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(C1=O)(C#CCN(C)C2=CC=CC3=CC=CC=C32)O)OC(C)C

Isomeric SMILES

CCCCC1=C(C(C1=O)(C#CCN(C)C2=CC=CC3=CC=CC=C32)O)OC(C)C

InChI

InChI=1S/C25H29NO3/c1-5-6-13-21-23(27)25(28,24(21)29-18(2)3)16-10-17-26(4)22-15-9-12-19-11-7-8-14-20(19)22/h7-9,11-12,14-15,18,28H,5-6,13,17H2,1-4H3