[4-butanoyloxy-2,3-dimethoxy-6-(propylamino)naphthalen-1-yl] benzoate

Systemtic Name: [4-butanoyloxy-2,3-dimethoxy-6-(propylamino)naphthalen-1-yl] benzoate Openeye Name: [4-butanoyloxy-2,3-dimethoxy-6-(propylamino)-1-naphthyl] benzoate CAS Name: benzoic acid [2,3-dimethoxy-4-(1-oxobutoxy)-6-(propylamino)-1-naphthalenyl] ester IUPAC Name: [4-butanoyloxy-2,3-dimethoxy-6-(propylamino)naphthalen-1-yl] benzoate Traditional Name: benzoic acid [4-butyryloxy-2,3-dimethoxy-6-(propylamino)-1-naphthyl] ester Formula: C26H29NO6 MolecularWeight: 451.51156

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1=C(C(=C(C2=C1C=C(C=C2)NCCC)OC(=O)C3=CC=CC=C3)OC)OC

Isomeric SMILES

CCCC(=O)OC1=C(C(=C(C2=C1C=C(C=C2)NCCC)OC(=O)C3=CC=CC=C3)OC)OC

InChI

InChI=1S/C26H29NO6/c1-5-10-21(28)32-23-20-16-18(27-15-6-2)13-14-19(20)22(24(30-3)25(23)31-4)33-26(29)17-11-8-7-9-12-17/h7-9,11-14,16,27H,5-6,10,15H2,1-4H3