10-hexyl-3,7-bis(2-nitrophenyl)phenothiazine

Systemtic Name: 10-hexyl-3,7-bis(2-nitrophenyl)phenothiazine Openeye Name: 10-hexyl-3,7-bis(2-nitrophenyl)phenothiazine CAS Name: 10-hexyl-3,7-bis(2-nitrophenyl)phenothiazine IUPAC Name: 10-hexyl-3,7-bis(2-nitrophenyl)phenothiazine Traditional Name: 10-hexyl-3,7-bis(2-nitrophenyl)phenothiazine Formula: C30H27N3O4S MolecularWeight: 525.61808

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C2=C(C=C(C=C2)C3=CC=CC=C3[N+](=O)[O-])SC4=C1C=CC(=C4)C5=CC=CC=C5[N+](=O)[O-]

Isomeric SMILES

CCCCCCN1C2=C(C=C(C=C2)C3=CC=CC=C3[N+](=O)[O-])SC4=C1C=CC(=C4)C5=CC=CC=C5[N+](=O)[O-]

InChI

InChI=1S/C30H27N3O4S/c1-2-3-4-9-18-31-27-16-14-21(23-10-5-7-12-25(23)32(34)35)19-29(27)38-30-20-22(15-17-28(30)31)24-11-6-8-13-26(24)33(36)37/h5-8,10-17,19-20H,2-4,9,18H2,1H3