7-ethanoyl-2-[4-(2-propan-2-yloxyethylamino)phenyl]-1,3-benzoxazole-5-carbonitrile

Systemtic Name: 7-ethanoyl-2-[4-(2-propan-2-yloxyethylamino)phenyl]-1,3-benzoxazole-5-carbonitrile Openeye Name: 7-acetyl-2-[4-(2-isopropoxyethylamino)phenyl]-1,3-benzoxazole-5-carbonitrile CAS Name: 7-acetyl-2-[4-(2-propan-2-yloxyethylamino)phenyl]-1,3-benzoxazole-5-carbonitrile IUPAC Name: 7-acetyl-2-[4-(2-propan-2-yloxyethylamino)phenyl]-1,3-benzoxazole-5-carbonitrile Traditional Name: 7-acetyl-2-[4-(2-isopropoxyethylamino)phenyl]-1,3-benzoxazole-5-carbonitrile Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCNC1=CC=C(C=C1)C2=NC3=CC(=CC(=C3O2)C(=O)C)C#N

Isomeric SMILES

CC(C)OCCNC1=CC=C(C=C1)C2=NC3=CC(=CC(=C3O2)C(=O)C)C#N

InChI

InChI=1S/C21H21N3O3/c1-13(2)26-9-8-23-17-6-4-16(5-7-17)21-24-19-11-15(12-22)10-18(14(3)25)20(19)27-21/h4-7,10-11,13,23H,8-9H2,1-3H3