(3R)-4-[(E)-4-(1-azanylcyclobutyl)but-2-enoyl]-3-(naphthalen-2-ylmethyl)-1-phenethyl-piperazin-2-one

Systemtic Name: (3R)-4-[(E)-4-(1-azanylcyclobutyl)but-2-enoyl]-3-(naphthalen-2-ylmethyl)-1-phenethyl-piperazin-2-one Openeye Name: (3R)-4-[(E)-4-(1-aminocyclobutyl)but-2-enoyl]-3-(2-naphthylmethyl)-1-phenethyl-piperazin-2-one CAS Name: (3R)-4-[(E)-4-(1-aminocyclobutyl)-1-oxobut-2-enyl]-3-(2-naphthalenylmethyl)-1-phenethyl-2-piperazinone IUPAC Name: (3R)-4-[(E)-4-(1-aminocyclobutyl)but-2-enoyl]-3-(naphthalen-2-ylmethyl)-1-phenethylpiperazin-2-one Traditional Name: (3R)-4-[(E)-4-(1-aminocyclobutyl)but-2-enoyl]-3-(2-naphthylmethyl)-1-phenethyl-piperazin-2-one Formula: C31H35N3O2 MolecularWeight: 481.6285

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)(CC=CC(=O)N2CCN(C(=O)C2CC3=CC4=CC=CC=C4C=C3)CCC5=CC=CC=C5)N

Isomeric SMILES

C1CC(C1)(C/C=C/C(=O)N2CCN(C(=O)[C@H]2CC3=CC4=CC=CC=C4C=C3)CCC5=CC=CC=C5)N

InChI

InChI=1S/C31H35N3O2/c32-31(17-7-18-31)16-6-12-29(35)34-21-20-33(19-15-24-8-2-1-3-9-24)30(36)28(34)23-25-13-14-26-10-4-5-11-27(26)22-25/h1-6,8-14,22,28H,7,15-21,23,32H2/b12-6+/t28-/m1/s1