(4S)-2-azanyl-4-(3-methoxy-4-phenylmethoxy-phenyl)-5-oxidanylidene-4H-pyrano[3,2-c]chromene-3-carbonitrile

Systemtic Name: (4S)-2-azanyl-4-(3-methoxy-4-phenylmethoxy-phenyl)-5-oxidanylidene-4H-pyrano[3,2-c]chromene-3-carbonitrile Openeye Name: (4S)-2-amino-4-(4-benzyloxy-3-methoxy-phenyl)-5-oxo-4H-pyrano[3,2-c]chromene-3-carbonitrile CAS Name: (4S)-2-amino-4-(3-methoxy-4-phenylmethoxyphenyl)-5-oxo-4H-pyrano[3,2-c][1]benzopyran-3-carbonitrile IUPAC Name: (4S)-2-amino-4-(3-methoxy-4-phenylmethoxyphenyl)-5-oxo-4H-pyrano[3,2-c]chromene-3-carbonitrile Traditional Name: (4S)-2-amino-4-(4-benzoxy-3-methoxy-phenyl)-5-keto-4H-pyrano[3,2-c]chromene-3-carbonitrile Formula: C27H20N2O5 MolecularWeight: 452.4581

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2C(=C(OC3=C2C(=O)OC4=CC=CC=C43)N)C#N)OCC5=CC=CC=C5

Isomeric SMILES

COC1=C(C=CC(=C1)[C@H]2C(=C(OC3=C2C(=O)OC4=CC=CC=C43)N)C#N)OCC5=CC=CC=C5

InChI

InChI=1S/C27H20N2O5/c1-31-22-13-17(11-12-21(22)32-15-16-7-3-2-4-8-16)23-19(14-28)26(29)34-25-18-9-5-6-10-20(18)33-27(30)24(23)25/h2-13,23H,15,29H2,1H3/t23-/m0/s1