5-[2-(3,4-dimethoxyphenyl)ethylamino]-2-[(3-methylphenoxy)methyl]-1,3-oxazole-4-carbonitrile

Systemtic Name: 5-[2-(3,4-dimethoxyphenyl)ethylamino]-2-[(3-methylphenoxy)methyl]-1,3-oxazole-4-carbonitrile Openeye Name: 5-[2-(3,4-dimethoxyphenyl)ethylamino]-2-[(3-methylphenoxy)methyl]oxazole-4-carbonitrile CAS Name: 5-[2-(3,4-dimethoxyphenyl)ethylamino]-2-[(3-methylphenoxy)methyl]-4-oxazolecarbonitrile IUPAC Name: 5-[2-(3,4-dimethoxyphenyl)ethylamino]-2-[(3-methylphenoxy)methyl]-1,3-oxazole-4-carbonitrile Traditional Name: 5-(homoveratrylamino)-2-[(3-methylphenoxy)methyl]oxazole-4-carbonitrile Formula: C22H23N3O4 MolecularWeight: 393.43572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC2=NC(=C(O2)NCCC3=CC(=C(C=C3)OC)OC)C#N

Isomeric SMILES

CC1=CC(=CC=C1)OCC2=NC(=C(O2)NCCC3=CC(=C(C=C3)OC)OC)C#N

InChI

InChI=1S/C22H23N3O4/c1-15-5-4-6-17(11-15)28-14-21-25-18(13-23)22(29-21)24-10-9-16-7-8-19(26-2)20(12-16)27-3/h4-8,11-12,24H,9-10,14H2,1-3H3