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phenyl 3-(tert-butylcarbamoyl)-3-[(phenylmethyl)amino]octanoate

phenyl 3-(tert-butylcarbamoyl)-3-[(phenylmethyl)amino]octanoate

Systemtic Name:phenyl 3-(tert-butylcarbamoyl)-3-[(phenylmethyl)amino]octanoate
Openeye Name:phenyl 3-(benzylamino)-3-(tert-butylcarbamoyl)octanoate
CAS Name:3-[(tert-butylamino)-oxomethyl]-3-[(phenylmethyl)amino]octanoic acid phenyl ester
IUPAC Name:phenyl 3-(benzylamino)-3-(tert-butylcarbamoyl)octanoate
Traditional Name:3-(benzylamino)-3-(tert-butylcarbamoyl)caprylic acid phenyl ester
Formula: C26H36N2O3
MolecularWeight: 424.57564
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC(=O)OC1=CC=CC=C1)(C(=O)NC(C)(C)C)NCC2=CC=CC=C2


Isomeric SMILES

CCCCCC(CC(=O)OC1=CC=CC=C1)(C(=O)NC(C)(C)C)NCC2=CC=CC=C2


InChI

InChI=1S/C26H36N2O3/c1-5-6-13-18-26(24(30)28-25(2,3)4,27-20-21-14-9-7-10-15-21)19-23(29)31-22-16-11-8-12-17-22/h7-12,14-17,27H,5-6,13,18-20H2,1-4H3,(H,28,30)


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