(4S,5S)-2-azanyl-4,5-bis(3,4-dimethoxyphenyl)cyclopent-2-ene-1,1,3-tricarbonitrile

Systemtic Name: (4S,5S)-2-azanyl-4,5-bis(3,4-dimethoxyphenyl)cyclopent-2-ene-1,1,3-tricarbonitrile Openeye Name: (4S,5S)-2-amino-4,5-bis(3,4-dimethoxyphenyl)cyclopent-2-ene-1,1,3-tricarbonitrile CAS Name: (4S,5S)-2-amino-4,5-bis(3,4-dimethoxyphenyl)cyclopent-2-ene-1,1,3-tricarbonitrile IUPAC Name: (4S,5S)-2-amino-4,5-bis(3,4-dimethoxyphenyl)cyclopent-2-ene-1,1,3-tricarbonitrile Traditional Name: (4S,5S)-2-amino-4,5-bis(3,4-dimethoxyphenyl)cyclopent-2-ene-1,1,3-tricarbonitrile Formula: C24H22N4O4 MolecularWeight: 430.45588

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2C(C(C(=C2C#N)N)(C#N)C#N)C3=CC(=C(C=C3)OC)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)[C@@H]2[C@H](C(C(=C2C#N)N)(C#N)C#N)C3=CC(=C(C=C3)OC)OC)OC

InChI

InChI=1S/C24H22N4O4/c1-29-17-7-5-14(9-19(17)31-3)21-16(11-25)23(28)24(12-26,13-27)22(21)15-6-8-18(30-2)20(10-15)32-4/h5-10,21-22H,28H2,1-4H3/t21-,22+/m0/s1