3-chloranyl-1-[2-[5-(2-methylphenyl)-1,3-benzoxazol-2-yl]pyrrolidin-1-yl]propan-1-one

Systemtic Name: 3-chloranyl-1-[2-[5-(2-methylphenyl)-1,3-benzoxazol-2-yl]pyrrolidin-1-yl]propan-1-one Openeye Name: 3-chloro-1-[2-[5-(o-tolyl)-1,3-benzoxazol-2-yl]pyrrolidin-1-yl]propan-1-one CAS Name: 3-chloro-1-[2-[5-(2-methylphenyl)-1,3-benzoxazol-2-yl]-1-pyrrolidinyl]-1-propanone IUPAC Name: 3-chloro-1-[2-[5-(2-methylphenyl)-1,3-benzoxazol-2-yl]pyrrolidin-1-yl]propan-1-one Traditional Name: 3-chloro-1-[2-[5-(o-tolyl)-1,3-benzoxazol-2-yl]pyrrolidino]propan-1-one Formula: C21H21ClN2O2 MolecularWeight: 368.85664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=CC3=C(C=C2)OC(=N3)C4CCCN4C(=O)CCCl

Isomeric SMILES

CC1=CC=CC=C1C2=CC3=C(C=C2)OC(=N3)C4CCCN4C(=O)CCCl

InChI

InChI=1S/C21H21ClN2O2/c1-14-5-2-3-6-16(14)15-8-9-19-17(13-15)23-21(26-19)18-7-4-12-24(18)20(25)10-11-22/h2-3,5-6,8-9,13,18H,4,7,10-12H2,1H3