1,5-dimethyl-4-[(E)-3-oxidanylidene-3-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)prop-1-enyl]pyrrole-2-carbonitrile

Systemtic Name: 1,5-dimethyl-4-[(E)-3-oxidanylidene-3-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)prop-1-enyl]pyrrole-2-carbonitrile Openeye Name: 1,5-dimethyl-4-[(E)-3-oxo-3-(3-oxo-4H-1,4-benzoxazin-6-yl)prop-1-enyl]pyrrole-2-carbonitrile CAS Name: 1,5-dimethyl-4-[(E)-3-oxo-3-(3-oxo-4H-1,4-benzoxazin-6-yl)prop-1-enyl]-2-pyrrolecarbonitrile IUPAC Name: 1,5-dimethyl-4-[(E)-3-oxo-3-(3-oxo-4H-1,4-benzoxazin-6-yl)prop-1-enyl]pyrrole-2-carbonitrile Traditional Name: 4-[(E)-3-keto-3-(3-keto-4H-1,4-benzoxazin-6-yl)prop-1-enyl]-1,5-dimethyl-pyrrole-2-carbonitrile Formula: C18H15N3O3 MolecularWeight: 321.33

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1C)C#N)C=CC(=O)C2=CC3=C(C=C2)OCC(=O)N3

Isomeric SMILES

CC1=C(C=C(N1C)C#N)/C=C/C(=O)C2=CC3=C(C=C2)OCC(=O)N3

InChI

InChI=1S/C18H15N3O3/c1-11-12(7-14(9-19)21(11)2)3-5-16(22)13-4-6-17-15(8-13)20-18(23)10-24-17/h3-8H,10H2,1-2H3,(H,20,23)/b5-3+