3-[(2-methylpropan-2-yl)oxycarbonyl-(3-oxidanylpropyl)amino]propyl anthracene-9-carboxylate

Systemtic Name: 3-[(2-methylpropan-2-yl)oxycarbonyl-(3-oxidanylpropyl)amino]propyl anthracene-9-carboxylate Openeye Name: 3-[tert-butoxycarbonyl(3-hydroxypropyl)amino]propyl anthracene-9-carboxylate CAS Name: 9-anthracenecarboxylic acid 3-[3-hydroxypropyl-[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propyl ester IUPAC Name: 3-[3-hydroxypropyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]propyl anthracene-9-carboxylate Traditional Name: anthracene-9-carboxylic acid 3-[tert-butoxycarbonyl(3-hydroxypropyl)amino]propyl ester Formula: C26H31NO5 MolecularWeight: 437.52804

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CCCO)CCCOC(=O)C1=C2C=CC=CC2=CC3=CC=CC=C31

Isomeric SMILES

CC(C)(C)OC(=O)N(CCCO)CCCOC(=O)C1=C2C=CC=CC2=CC3=CC=CC=C31

InChI

InChI=1S/C26H31NO5/c1-26(2,3)32-25(30)27(14-8-16-28)15-9-17-31-24(29)23-21-12-6-4-10-19(21)18-20-11-5-7-13-22(20)23/h4-7,10-13,18,28H,8-9,14-17H2,1-3H3