[6-[(4-bromophenyl)amino]-9-phenoxy-12H-benzo[a]phenothiazin-5-yl] ethanoate

Systemtic Name: [6-[(4-bromophenyl)amino]-9-phenoxy-12H-benzo[a]phenothiazin-5-yl] ethanoate Openeye Name: [6-(4-bromoanilino)-9-phenoxy-12H-benzo[a]phenothiazin-5-yl] acetate CAS Name: acetic acid [6-(4-bromoanilino)-9-phenoxy-12H-benzo[a]phenothiazin-5-yl] ester IUPAC Name: [6-(4-bromoanilino)-9-phenoxy-12H-benzo[a]phenothiazin-5-yl] acetate Traditional Name: acetic acid [6-(4-bromoanilino)-9-phenoxy-12H-benzo[a]phenothiazin-5-yl] ester Formula: C30H21BrN2O3S MolecularWeight: 569.46834

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C2=C(C3=CC=CC=C31)NC4=C(S2)C=C(C=C4)OC5=CC=CC=C5)NC6=CC=C(C=C6)Br

Isomeric SMILES

CC(=O)OC1=C(C2=C(C3=CC=CC=C31)NC4=C(S2)C=C(C=C4)OC5=CC=CC=C5)NC6=CC=C(C=C6)Br

InChI

InChI=1S/C30H21BrN2O3S/c1-18(34)35-29-24-10-6-5-9-23(24)27-30(28(29)32-20-13-11-19(31)12-14-20)37-26-17-22(15-16-25(26)33-27)36-21-7-3-2-4-8-21/h2-17,32-33H,1H3