(4S)-5-oxidanylidene-2-pyrrol-1-yl-4-(3,4,5-trimethoxyphenyl)-4,6,7,8-tetrahydrochromene-3-carbonitrile

Systemtic Name: (4S)-5-oxidanylidene-2-pyrrol-1-yl-4-(3,4,5-trimethoxyphenyl)-4,6,7,8-tetrahydrochromene-3-carbonitrile Openeye Name: (4S)-5-oxo-2-pyrrol-1-yl-4-(3,4,5-trimethoxyphenyl)-4,6,7,8-tetrahydrochromene-3-carbonitrile CAS Name: (4S)-5-oxo-2-(1-pyrrolyl)-4-(3,4,5-trimethoxyphenyl)-4,6,7,8-tetrahydro-1-benzopyran-3-carbonitrile IUPAC Name: (4S)-5-oxo-2-pyrrol-1-yl-4-(3,4,5-trimethoxyphenyl)-4,6,7,8-tetrahydrochromene-3-carbonitrile Traditional Name: (4S)-5-keto-2-pyrrol-1-yl-4-(3,4,5-trimethoxyphenyl)-4,6,7,8-tetrahydrochromene-3-carbonitrile Formula: C23H22N2O5 MolecularWeight: 406.43118

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2C(=C(OC3=C2C(=O)CCC3)N4C=CC=C4)C#N

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)[C@H]2C(=C(OC3=C2C(=O)CCC3)N4C=CC=C4)C#N

InChI

InChI=1S/C23H22N2O5/c1-27-18-11-14(12-19(28-2)22(18)29-3)20-15(13-24)23(25-9-4-5-10-25)30-17-8-6-7-16(26)21(17)20/h4-5,9-12,20H,6-8H2,1-3H3/t20-/m0/s1