heptadecyl 4-[7-(diethylamino)-2-oxidanylidene-chromen-3-yl]benzoate

Systemtic Name: heptadecyl 4-[7-(diethylamino)-2-oxidanylidene-chromen-3-yl]benzoate Openeye Name: heptadecyl 4-[7-(diethylamino)-2-oxo-chromen-3-yl]benzoate CAS Name: 4-[7-(diethylamino)-2-oxo-1-benzopyran-3-yl]benzoic acid heptadecyl ester IUPAC Name: heptadecyl 4-[7-(diethylamino)-2-oxochromen-3-yl]benzoate Traditional Name: 4-[7-(diethylamino)-2-keto-chromen-3-yl]benzoic acid heptadecyl ester Formula: C37H53NO4 MolecularWeight: 575.82102

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCOC(=O)C1=CC=C(C=C1)C2=CC3=C(C=C(C=C3)N(CC)CC)OC2=O

Isomeric SMILES

CCCCCCCCCCCCCCCCCOC(=O)C1=CC=C(C=C1)C2=CC3=C(C=C(C=C3)N(CC)CC)OC2=O

InChI

InChI=1S/C37H53NO4/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-20-27-41-36(39)31-23-21-30(22-24-31)34-28-32-25-26-33(38(5-2)6-3)29-35(32)42-37(34)40/h21-26,28-29H,4-20,27H2,1-3H3