[2-(3-azanylpropanoyloxy)-3-heptadecyl-phenyl] 3-azanylpropanoate

Systemtic Name: [2-(3-azanylpropanoyloxy)-3-heptadecyl-phenyl] 3-azanylpropanoate Openeye Name: [2-(3-aminopropanoyloxy)-3-heptadecyl-phenyl] 3-aminopropanoate CAS Name: 3-aminopropanoic acid [2-(3-amino-1-oxopropoxy)-3-heptadecylphenyl] ester IUPAC Name: [2-(3-aminopropanoyloxy)-3-heptadecylphenyl] 3-aminopropanoate Traditional Name: 3-aminopropionic acid [2-(3-aminopropanoyloxy)-3-heptadecyl-phenyl] ester Formula: C29H50N2O4 MolecularWeight: 490.7183

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC1=C(C(=CC=C1)OC(=O)CCN)OC(=O)CCN

Isomeric SMILES

CCCCCCCCCCCCCCCCCC1=C(C(=CC=C1)OC(=O)CCN)OC(=O)CCN

InChI

InChI=1S/C29H50N2O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-25-19-17-20-26(34-27(32)21-23-30)29(25)35-28(33)22-24-31/h17,19-20H,2-16,18,21-24,30-31H2,1H3