4-[2-azanyl-5-oxidanylidene-3-(phenoxymethyl)-4H-pyrano[3,2-c]chromen-4-yl]benzenecarbonitrile

Systemtic Name: 4-[2-azanyl-5-oxidanylidene-3-(phenoxymethyl)-4H-pyrano[3,2-c]chromen-4-yl]benzenecarbonitrile Openeye Name: 4-[2-amino-5-oxo-3-(phenoxymethyl)-4H-pyrano[3,2-c]chromen-4-yl]benzonitrile CAS Name: 4-[2-amino-5-oxo-3-(phenoxymethyl)-4H-pyrano[3,2-c][1]benzopyran-4-yl]benzonitrile IUPAC Name: 4-[2-amino-5-oxo-3-(phenoxymethyl)-4H-pyrano[3,2-c]chromen-4-yl]benzonitrile Traditional Name: 4-[2-amino-5-keto-3-(phenoxymethyl)-4H-pyrano[3,2-c]chromen-4-yl]benzonitrile Formula: C26H18N2O4 MolecularWeight: 422.43212

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC2=C(OC3=C(C2C4=CC=C(C=C4)C#N)C(=O)OC5=CC=CC=C53)N

Isomeric SMILES

C1=CC=C(C=C1)OCC2=C(OC3=C(C2C4=CC=C(C=C4)C#N)C(=O)OC5=CC=CC=C53)N

InChI

InChI=1S/C26H18N2O4/c27-14-16-10-12-17(13-11-16)22-20(15-30-18-6-2-1-3-7-18)25(28)32-24-19-8-4-5-9-21(19)31-26(29)23(22)24/h1-13,22H,15,28H2