[4-acetyloxy-7-(4-nitrophenyl)sulfanyl-3-propoxy-naphthalen-1-yl] ethanoate

Systemtic Name: [4-acetyloxy-7-(4-nitrophenyl)sulfanyl-3-propoxy-naphthalen-1-yl] ethanoate Openeye Name: [4-acetoxy-7-(4-nitrophenyl)sulfanyl-3-propoxy-1-naphthyl] acetate CAS Name: acetic acid [4-acetyloxy-7-[(4-nitrophenyl)thio]-3-propoxy-1-naphthalenyl] ester IUPAC Name: [4-acetyloxy-7-(4-nitrophenyl)sulfanyl-3-propoxynaphthalen-1-yl] acetate Traditional Name: acetic acid [4-acetoxy-7-[(4-nitrophenyl)thio]-3-propoxy-1-naphthyl] ester Formula: C23H21NO7S MolecularWeight: 455.48034

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C2=C(C=C(C=C2)SC3=CC=C(C=C3)[N+](=O)[O-])C(=C1)OC(=O)C)OC(=O)C

Isomeric SMILES

CCCOC1=C(C2=C(C=C(C=C2)SC3=CC=C(C=C3)[N+](=O)[O-])C(=C1)OC(=O)C)OC(=O)C

InChI

InChI=1S/C23H21NO7S/c1-4-11-29-22-13-21(30-14(2)25)20-12-18(9-10-19(20)23(22)31-15(3)26)32-17-7-5-16(6-8-17)24(27)28/h5-10,12-13H,4,11H2,1-3H3