[9-azanyl-2-methyl-4-oxidanylidene-5-[2-(prop-2-enylamino)ethanoylamino]nonan-2-yl] methanoate

Systemtic Name: [9-azanyl-2-methyl-4-oxidanylidene-5-[2-(prop-2-enylamino)ethanoylamino]nonan-2-yl] methanoate Openeye Name: [4-[[2-(allylamino)acetyl]amino]-8-amino-1,1-dimethyl-3-oxo-octyl] formate CAS Name: formic acid [9-amino-2-methyl-4-oxo-5-[[1-oxo-2-(prop-2-enylamino)ethyl]amino]nonan-2-yl] ester IUPAC Name: [9-amino-2-methyl-4-oxo-5-[[2-(prop-2-enylamino)acetyl]amino]nonan-2-yl] formate Traditional Name: formic acid [4-[[2-(allylamino)acetyl]amino]-8-amino-3-keto-1,1-dimethyl-octyl] ester Formula: C16H29N3O4 MolecularWeight: 327.41916

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(=O)C(CCCCN)NC(=O)CNCC=C)OC=O

Isomeric SMILES

CC(C)(CC(=O)C(CCCCN)NC(=O)CNCC=C)OC=O

InChI

InChI=1S/C16H29N3O4/c1-4-9-18-11-15(22)19-13(7-5-6-8-17)14(21)10-16(2,3)23-12-20/h4,12-13,18H,1,5-11,17H2,2-3H3,(H,19,22)