2-azanyl-4-(2,5-diethoxyphenyl)-1-(2-ethylphenyl)-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-azanyl-4-(2,5-diethoxyphenyl)-1-(2-ethylphenyl)-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-4-(2,5-diethoxyphenyl)-1-(2-ethylphenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-4-(2,5-diethoxyphenyl)-1-(2-ethylphenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-4-(2,5-diethoxyphenyl)-1-(2-ethylphenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-4-(2,5-diethoxyphenyl)-1-(2-ethylphenyl)-5-keto-4,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C28H31N3O3 MolecularWeight: 457.56404

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1N2C3=C(C(C(=C2N)C#N)C4=C(C=CC(=C4)OCC)OCC)C(=O)CCC3

Isomeric SMILES

CCC1=CC=CC=C1N2C3=C(C(C(=C2N)C#N)C4=C(C=CC(=C4)OCC)OCC)C(=O)CCC3

InChI

InChI=1S/C28H31N3O3/c1-4-18-10-7-8-11-22(18)31-23-12-9-13-24(32)27(23)26(21(17-29)28(31)30)20-16-19(33-5-2)14-15-25(20)34-6-3/h7-8,10-11,14-16,26H,4-6,9,12-13,30H2,1-3H3