N-[(E)-1-(3,7-dimethyl-1-benzothiophen-2-yl)ethylideneamino]-2,4-dinitro-aniline

Systemtic Name: N-[(E)-1-(3,7-dimethyl-1-benzothiophen-2-yl)ethylideneamino]-2,4-dinitro-aniline Openeye Name: N-[(E)-1-(3,7-dimethylbenzothiophen-2-yl)ethylideneamino]-2,4-dinitro-aniline CAS Name: N-[(E)-1-(3,7-dimethyl-1-benzothiophen-2-yl)ethylideneamino]-2,4-dinitroaniline IUPAC Name: N-[(E)-1-(3,7-dimethyl-1-benzothiophen-2-yl)ethylideneamino]-2,4-dinitroaniline Traditional Name: [(E)-1-(3,7-dimethylbenzothiophen-2-yl)ethylideneamino]-(2,4-dinitrophenyl)amine Formula: C18H16N4O4S MolecularWeight: 384.40904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1SC(=C2C)C(=NNC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])C

Isomeric SMILES

CC1=CC=CC2=C1SC(=C2C)/C(=N/NC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])/C

InChI

InChI=1S/C18H16N4O4S/c1-10-5-4-6-14-11(2)18(27-17(10)14)12(3)19-20-15-8-7-13(21(23)24)9-16(15)22(25)26/h4-9,20H,1-3H3/b19-12+