2,3-bis(azanyl)-7-[(4-chloranyl-5-methoxy-2-methyl-phenyl)amino]quinoline-4-carbonitrile

Systemtic Name: 2,3-bis(azanyl)-7-[(4-chloranyl-5-methoxy-2-methyl-phenyl)amino]quinoline-4-carbonitrile Openeye Name: 2,3-diamino-7-(4-chloro-5-methoxy-2-methyl-anilino)quinoline-4-carbonitrile CAS Name: 2,3-diamino-7-(4-chloro-5-methoxy-2-methylanilino)-4-quinolinecarbonitrile IUPAC Name: 2,3-diamino-7-(4-chloro-5-methoxy-2-methylanilino)quinoline-4-carbonitrile Traditional Name: 2,3-diamino-7-(4-chloro-5-methoxy-2-methyl-anilino)cinchoninonitrile Formula: C18H16ClN5O MolecularWeight: 353.80554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1NC2=CC3=NC(=C(C(=C3C=C2)C#N)N)N)OC)Cl

Isomeric SMILES

CC1=CC(=C(C=C1NC2=CC3=NC(=C(C(=C3C=C2)C#N)N)N)OC)Cl

InChI

InChI=1S/C18H16ClN5O/c1-9-5-13(19)16(25-2)7-14(9)23-10-3-4-11-12(8-20)17(21)18(22)24-15(11)6-10/h3-7,23H,21H2,1-2H3,(H2,22,24)