5-[(3-methylphenyl)methyl]-4-oxidanylidene-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinoxaline-7-carbonitrile

Systemtic Name: 5-[(3-methylphenyl)methyl]-4-oxidanylidene-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinoxaline-7-carbonitrile Openeye Name: 5-(m-tolylmethyl)-4-oxo-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinoxaline-7-carbonitrile CAS Name: 5-[(3-methylphenyl)methyl]-4-oxo-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinoxaline-7-carbonitrile IUPAC Name: 5-[(3-methylphenyl)methyl]-4-oxo-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinoxaline-7-carbonitrile Traditional Name: 4-keto-5-(3-methylbenzyl)-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinoxaline-7-carbonitrile Formula: C20H19N3O MolecularWeight: 317.38436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C3=C(C=CC(=C3)C#N)N4CCCC4C2=O

Isomeric SMILES

CC1=CC(=CC=C1)CN2C3=C(C=CC(=C3)C#N)N4CCCC4C2=O

InChI

InChI=1S/C20H19N3O/c1-14-4-2-5-16(10-14)13-23-19-11-15(12-21)7-8-17(19)22-9-3-6-18(22)20(23)24/h2,4-5,7-8,10-11,18H,3,6,9,13H2,1H3