4,5-bis(chloranyl)-1-(4-methylphenyl)-3-[(4-methylphenyl)amino]-6-oxidanyl-indole-7-carbonitrile

Systemtic Name: 4,5-bis(chloranyl)-1-(4-methylphenyl)-3-[(4-methylphenyl)amino]-6-oxidanyl-indole-7-carbonitrile Openeye Name: 4,5-dichloro-6-hydroxy-3-(4-methylanilino)-1-(p-tolyl)indole-7-carbonitrile CAS Name: 4,5-dichloro-6-hydroxy-3-(4-methylanilino)-1-(4-methylphenyl)-7-indolecarbonitrile IUPAC Name: 4,5-dichloro-6-hydroxy-3-(4-methylanilino)-1-(4-methylphenyl)indole-7-carbonitrile Traditional Name: 4,5-dichloro-6-hydroxy-3-(p-toluidino)-1-(p-tolyl)indole-7-carbonitrile Formula: C23H17Cl2N3O MolecularWeight: 422.30658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=CN(C3=C(C(=C(C(=C23)Cl)Cl)O)C#N)C4=CC=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)NC2=CN(C3=C(C(=C(C(=C23)Cl)Cl)O)C#N)C4=CC=C(C=C4)C

InChI

InChI=1S/C23H17Cl2N3O/c1-13-3-7-15(8-4-13)27-18-12-28(16-9-5-14(2)6-10-16)22-17(11-26)23(29)21(25)20(24)19(18)22/h3-10,12,27,29H,1-2H3