6-ethoxy-4-[(4-propan-2-ylphenyl)amino]quinoline-3-carbonitrile

Systemtic Name: 6-ethoxy-4-[(4-propan-2-ylphenyl)amino]quinoline-3-carbonitrile Openeye Name: 6-ethoxy-4-(4-isopropylanilino)quinoline-3-carbonitrile CAS Name: 6-ethoxy-4-(4-propan-2-ylanilino)-3-quinolinecarbonitrile IUPAC Name: 6-ethoxy-4-(4-propan-2-ylanilino)quinoline-3-carbonitrile Traditional Name: 4-cumidino-6-ethoxy-quinoline-3-carbonitrile Formula: C21H21N3O MolecularWeight: 331.41094

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C(=CN=C2C=C1)C#N)NC3=CC=C(C=C3)C(C)C

Isomeric SMILES

CCOC1=CC2=C(C(=CN=C2C=C1)C#N)NC3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C21H21N3O/c1-4-25-18-9-10-20-19(11-18)21(16(12-22)13-23-20)24-17-7-5-15(6-8-17)14(2)3/h5-11,13-14H,4H2,1-3H3,(H,23,24)