5-chloranyl-2-[3-(4-methylphenyl)-2-pyridin-2-yl-pyrrolidin-1-yl]-1,3-benzoxazole

Systemtic Name: 5-chloranyl-2-[3-(4-methylphenyl)-2-pyridin-2-yl-pyrrolidin-1-yl]-1,3-benzoxazole Openeye Name: 5-chloro-2-[3-(p-tolyl)-2-(2-pyridyl)pyrrolidin-1-yl]-1,3-benzoxazole CAS Name: 5-chloro-2-[3-(4-methylphenyl)-2-(2-pyridinyl)-1-pyrrolidinyl]-1,3-benzoxazole IUPAC Name: 5-chloro-2-[3-(4-methylphenyl)-2-pyridin-2-ylpyrrolidin-1-yl]-1,3-benzoxazole Traditional Name: 5-chloro-2-[3-(p-tolyl)-2-(2-pyridyl)pyrrolidino]-1,3-benzoxazole Formula: C23H20ClN3O MolecularWeight: 389.8774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CCN(C2C3=CC=CC=N3)C4=NC5=C(O4)C=CC(=C5)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C2CCN(C2C3=CC=CC=N3)C4=NC5=C(O4)C=CC(=C5)Cl

InChI

InChI=1S/C23H20ClN3O/c1-15-5-7-16(8-6-15)18-11-13-27(22(18)19-4-2-3-12-25-19)23-26-20-14-17(24)9-10-21(20)28-23/h2-10,12,14,18,22H,11,13H2,1H3