4-[(2-cyclopropyl-1,3-benzoxazol-6-yl)carbonyl]-3-(phenylmethyl)piperazin-2-one

Systemtic Name: 4-[(2-cyclopropyl-1,3-benzoxazol-6-yl)carbonyl]-3-(phenylmethyl)piperazin-2-one Openeye Name: 3-benzyl-4-(2-cyclopropyl-1,3-benzoxazole-6-carbonyl)piperazin-2-one CAS Name: 4-[(2-cyclopropyl-1,3-benzoxazol-6-yl)-oxomethyl]-3-(phenylmethyl)-2-piperazinone IUPAC Name: 3-benzyl-4-(2-cyclopropyl-1,3-benzoxazole-6-carbonyl)piperazin-2-one Traditional Name: 3-benzyl-4-(2-cyclopropyl-1,3-benzoxazole-6-carbonyl)piperazin-2-one Formula: C22H21N3O3 MolecularWeight: 375.42044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NC3=C(O2)C=C(C=C3)C(=O)N4CCNC(=O)C4CC5=CC=CC=C5

Isomeric SMILES

C1CC1C2=NC3=C(O2)C=C(C=C3)C(=O)N4CCNC(=O)C4CC5=CC=CC=C5

InChI

InChI=1S/C22H21N3O3/c26-20-18(12-14-4-2-1-3-5-14)25(11-10-23-20)22(27)16-8-9-17-19(13-16)28-21(24-17)15-6-7-15/h1-5,8-9,13,15,18H,6-7,10-12H2,(H,23,26)