methyl 7-[3-(4-aminocarbonyl-3-oxidanyl-2-prop-2-enyl-phenoxy)propoxy]-8-propyl-3,4-dihydro-2H-chromene-2-carboxylate

Systemtic Name: methyl 7-[3-(4-aminocarbonyl-3-oxidanyl-2-prop-2-enyl-phenoxy)propoxy]-8-propyl-3,4-dihydro-2H-chromene-2-carboxylate Openeye Name: methyl 7-[3-(2-allyl-4-carbamoyl-3-hydroxy-phenoxy)propoxy]-8-propyl-chromane-2-carboxylate CAS Name: 7-[3-(4-carbamoyl-3-hydroxy-2-prop-2-enylphenoxy)propoxy]-8-propyl-3,4-dihydro-2H-1-benzopyran-2-carboxylic acid methyl ester IUPAC Name: methyl 7-[3-(4-carbamoyl-3-hydroxy-2-prop-2-enylphenoxy)propoxy]-8-propyl-3,4-dihydro-2H-chromene-2-carboxylate Traditional Name: 7-[3-(2-allyl-4-carbamoyl-3-hydroxy-phenoxy)propoxy]-8-propyl-chroman-2-carboxylic acid methyl ester Formula: C27H33NO7 MolecularWeight: 483.55342

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC2=C1OC(CC2)C(=O)OC)OCCCOC3=C(C(=C(C=C3)C(=O)N)O)CC=C

Isomeric SMILES

CCCC1=C(C=CC2=C1OC(CC2)C(=O)OC)OCCCOC3=C(C(=C(C=C3)C(=O)N)O)CC=C

InChI

InChI=1S/C27H33NO7/c1-4-7-18-21(14-11-20(24(18)29)26(28)30)33-15-6-16-34-22-12-9-17-10-13-23(27(31)32-3)35-25(17)19(22)8-5-2/h4,9,11-12,14,23,29H,1,5-8,10,13,15-16H2,2-3H3,(H2,28,30)