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

Systemtic Name: (4S)-2-azanyl-4-(3-butoxy-4-methoxy-phenyl)-5-oxidanylidene-4H-pyrano[3,2-c]chromene-3-carbonitrile Openeye Name: (4S)-2-amino-4-(3-butoxy-4-methoxy-phenyl)-5-oxo-4H-pyrano[3,2-c]chromene-3-carbonitrile CAS Name: (4S)-2-amino-4-(3-butoxy-4-methoxyphenyl)-5-oxo-4H-pyrano[3,2-c][1]benzopyran-3-carbonitrile IUPAC Name: (4S)-2-amino-4-(3-butoxy-4-methoxyphenyl)-5-oxo-4H-pyrano[3,2-c]chromene-3-carbonitrile Traditional Name: (4S)-2-amino-4-(3-butoxy-4-methoxy-phenyl)-5-keto-4H-pyrano[3,2-c]chromene-3-carbonitrile Formula: C24H22N2O5 MolecularWeight: 418.44188

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=CC(=C1)C2C(=C(OC3=C2C(=O)OC4=CC=CC=C43)N)C#N)OC

Isomeric SMILES

CCCCOC1=C(C=CC(=C1)[C@H]2C(=C(OC3=C2C(=O)OC4=CC=CC=C43)N)C#N)OC

InChI

InChI=1S/C24H22N2O5/c1-3-4-11-29-19-12-14(9-10-18(19)28-2)20-16(13-25)23(26)31-22-15-7-5-6-8-17(15)30-24(27)21(20)22/h5-10,12,20H,3-4,11,26H2,1-2H3/t20-/m0/s1