methyl 5-[3-[5-azanyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxidanylidene-pentoxy]phenyl]pyridine-3-carboxylate

Systemtic Name: methyl 5-[3-[5-azanyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxidanylidene-pentoxy]phenyl]pyridine-3-carboxylate Openeye Name: methyl 5-[3-[5-amino-3-(tert-butoxycarbonylamino)-5-oxo-pentoxy]phenyl]pyridine-3-carboxylate CAS Name: 5-[3-[5-amino-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-5-oxopentoxy]phenyl]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-[3-[5-amino-3-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxopentoxy]phenyl]pyridine-3-carboxylate Traditional Name: 5-[3-[5-amino-3-(tert-butoxycarbonylamino)-5-keto-pentoxy]phenyl]nicotinic acid methyl ester Formula: C23H29N3O6 MolecularWeight: 443.49286

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCOC1=CC=CC(=C1)C2=CC(=CN=C2)C(=O)OC)CC(=O)N

Isomeric SMILES

CC(C)(C)OC(=O)NC(CCOC1=CC=CC(=C1)C2=CC(=CN=C2)C(=O)OC)CC(=O)N

InChI

InChI=1S/C23H29N3O6/c1-23(2,3)32-22(29)26-18(12-20(24)27)8-9-31-19-7-5-6-15(11-19)16-10-17(14-25-13-16)21(28)30-4/h5-7,10-11,13-14,18H,8-9,12H2,1-4H3,(H2,24,27)(H,26,29)