1,5-dimethyl-4-[(E)-[2-(3-methylphenyl)-5-oxidanylidene-1,3-oxazol-4-ylidene]methyl]pyrrole-2-carbonitrile

Systemtic Name: 1,5-dimethyl-4-[(E)-[2-(3-methylphenyl)-5-oxidanylidene-1,3-oxazol-4-ylidene]methyl]pyrrole-2-carbonitrile Openeye Name: 1,5-dimethyl-4-[(E)-[2-(m-tolyl)-5-oxo-oxazol-4-ylidene]methyl]pyrrole-2-carbonitrile CAS Name: 1,5-dimethyl-4-[(E)-[2-(3-methylphenyl)-5-oxo-4-oxazolylidene]methyl]-2-pyrrolecarbonitrile IUPAC Name: 1,5-dimethyl-4-[(E)-[2-(3-methylphenyl)-5-oxo-1,3-oxazol-4-ylidene]methyl]pyrrole-2-carbonitrile Traditional Name: 4-[(E)-[5-keto-2-(m-tolyl)-2-oxazolin-4-ylidene]methyl]-1,5-dimethyl-pyrrole-2-carbonitrile Formula: C18H15N3O2 MolecularWeight: 305.3306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC(=CC3=C(N(C(=C3)C#N)C)C)C(=O)O2

Isomeric SMILES

CC1=CC=CC(=C1)C2=N/C(=C/C3=C(N(C(=C3)C#N)C)C)/C(=O)O2

InChI

InChI=1S/C18H15N3O2/c1-11-5-4-6-13(7-11)17-20-16(18(22)23-17)9-14-8-15(10-19)21(3)12(14)2/h4-9H,1-3H3/b16-9+