2-[(2-azanyl-3-pyridin-4-yl-propanoyl)amino]-N-tert-butyl-3-[4-(phenylcarbonyloxy)phenyl]propanimidate

Systemtic Name: 2-[(2-azanyl-3-pyridin-4-yl-propanoyl)amino]-N-tert-butyl-3-[4-(phenylcarbonyloxy)phenyl]propanimidate Openeye Name: 2-[[2-amino-3-(4-pyridyl)propanoyl]amino]-3-(4-benzoyloxyphenyl)-N-tert-butyl-propanimidate CAS Name: 2-[(2-amino-1-oxo-3-pyridin-4-ylpropyl)amino]-3-(4-benzoyloxyphenyl)-N-tert-butylpropanimidate IUPAC Name: 2-[(2-amino-3-pyridin-4-ylpropanoyl)amino]-3-(4-benzoyloxyphenyl)-N-tert-butylpropanimidate Traditional Name: 2-[[2-amino-3-(4-pyridyl)propanoyl]amino]-3-(4-benzoyloxyphenyl)-N-tert-butyl-propionimidate Formula: C28H31N4O4- MolecularWeight: 487.57014

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N=C(C(CC1=CC=C(C=C1)OC(=O)C2=CC=CC=C2)NC(=O)C(CC3=CC=NC=C3)N)[O-]

Isomeric SMILES

CC(C)(C)N=C(C(CC1=CC=C(C=C1)OC(=O)C2=CC=CC=C2)NC(=O)C(CC3=CC=NC=C3)N)[O-]

InChI

InChI=1S/C28H32N4O4/c1-28(2,3)32-26(34)24(31-25(33)23(29)17-20-13-15-30-16-14-20)18-19-9-11-22(12-10-19)36-27(35)21-7-5-4-6-8-21/h4-16,23-24H,17-18,29H2,1-3H3,(H,31,33)(H,32,34)/p-1