N-[[3,5-bis(chloranyl)-4-prop-2-ynoxy-phenyl]methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[[3,5-bis(chloranyl)-4-prop-2-ynoxy-phenyl]methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-[(3,5-dichloro-4-prop-2-ynoxy-phenyl)methyleneamino]-5-nitro-benzothiophene-2-carboxamide CAS Name: N-[(3,5-dichloro-4-prop-2-ynoxyphenyl)methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-[(3,5-dichloro-4-prop-2-ynoxyphenyl)methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-[(3,5-dichloro-4-propargyloxy-benzylidene)amino]-5-nitro-benzothiophene-2-carboxamide Formula: C19H11Cl2N3O4S MolecularWeight: 448.27934

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CCOC1=C(C=C(C=C1Cl)C=NNC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C#CCOC1=C(C=C(C=C1Cl)C=NNC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C19H11Cl2N3O4S/c1-2-5-28-18-14(20)6-11(7-15(18)21)10-22-23-19(25)17-9-12-8-13(24(26)27)3-4-16(12)29-17/h1,3-4,6-10H,5H2,(H,23,25)