docosyl N-[4-[7-(diethylamino)-2-oxidanylidene-chromen-3-yl]phenyl]carbamate

Systemtic Name: docosyl N-[4-[7-(diethylamino)-2-oxidanylidene-chromen-3-yl]phenyl]carbamate Openeye Name: docosyl N-[4-[7-(diethylamino)-2-oxo-chromen-3-yl]phenyl]carbamate CAS Name: N-[4-[7-(diethylamino)-2-oxo-1-benzopyran-3-yl]phenyl]carbamic acid docosyl ester IUPAC Name: docosyl N-[4-[7-(diethylamino)-2-oxochromen-3-yl]phenyl]carbamate Traditional Name: N-[4-[7-(diethylamino)-2-keto-chromen-3-yl]phenyl]carbamic acid behenyl ester Formula: C42H64N2O4 MolecularWeight: 660.96856

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCOC(=O)NC1=CC=C(C=C1)C2=CC3=C(C=C(C=C3)N(CC)CC)OC2=O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCOC(=O)NC1=CC=C(C=C1)C2=CC3=C(C=C(C=C3)N(CC)CC)OC2=O

InChI

InChI=1S/C42H64N2O4/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-32-47-42(46)43-37-29-26-35(27-30-37)39-33-36-28-31-38(44(5-2)6-3)34-40(36)48-41(39)45/h26-31,33-34H,4-25,32H2,1-3H3,(H,43,46)