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1,3-dioxan-5-yl 4-(hexadecylamino)-2-phenyl-benzoate

1,3-dioxan-5-yl 4-(hexadecylamino)-2-phenyl-benzoate

Systemtic Name:1,3-dioxan-5-yl 4-(hexadecylamino)-2-phenyl-benzoate
Openeye Name:1,3-dioxan-5-yl 4-(hexadecylamino)-2-phenyl-benzoate
CAS Name:4-(hexadecylamino)-2-phenylbenzoic acid 1,3-dioxan-5-yl ester
IUPAC Name:1,3-dioxan-5-yl 4-(hexadecylamino)-2-phenylbenzoate
Traditional Name:4-(cetylamino)-2-phenyl-benzoic acid 1,3-dioxan-5-yl ester
Formula: C33H49NO4
MolecularWeight: 523.74646
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC1=CC(=C(C=C1)C(=O)OC2COCOC2)C3=CC=CC=C3


Isomeric SMILES

CCCCCCCCCCCCCCCCNC1=CC(=C(C=C1)C(=O)OC2COCOC2)C3=CC=CC=C3


InChI

InChI=1S/C33H49NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-23-34-29-21-22-31(32(24-29)28-19-16-15-17-20-28)33(35)38-30-25-36-27-37-26-30/h15-17,19-22,24,30,34H,2-14,18,23,25-27H2,1H3


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