4-[4-azanyl-5-[(4-cyanophenyl)amino]-2-nitro-phenoxy]-3,5-dimethyl-benzenecarbonitrile

Systemtic Name: 4-[4-azanyl-5-[(4-cyanophenyl)amino]-2-nitro-phenoxy]-3,5-dimethyl-benzenecarbonitrile Openeye Name: 4-[4-amino-5-(4-cyanoanilino)-2-nitro-phenoxy]-3,5-dimethyl-benzonitrile CAS Name: 4-[4-amino-5-(4-cyanoanilino)-2-nitrophenoxy]-3,5-dimethylbenzonitrile IUPAC Name: 4-[4-amino-5-(4-cyanoanilino)-2-nitrophenoxy]-3,5-dimethylbenzonitrile Traditional Name: 4-[4-amino-5-(4-cyanoanilino)-2-nitro-phenoxy]-3,5-dimethyl-benzonitrile Formula: C22H17N5O3 MolecularWeight: 399.40208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC2=C(C=C(C(=C2)NC3=CC=C(C=C3)C#N)N)[N+](=O)[O-])C)C#N

Isomeric SMILES

CC1=CC(=CC(=C1OC2=C(C=C(C(=C2)NC3=CC=C(C=C3)C#N)N)[N+](=O)[O-])C)C#N

InChI

InChI=1S/C22H17N5O3/c1-13-7-16(12-24)8-14(2)22(13)30-21-10-19(18(25)9-20(21)27(28)29)26-17-5-3-15(11-23)4-6-17/h3-10,26H,25H2,1-2H3