methyl 2-[2-(1,4-diazepan-1-yl)ethanoylamino]-3-methyl-pentanoate

Systemtic Name: methyl 2-[2-(1,4-diazepan-1-yl)ethanoylamino]-3-methyl-pentanoate Openeye Name: methyl 2-[[2-(1,4-diazepan-1-yl)acetyl]amino]-3-methyl-pentanoate CAS Name: 2-[[2-(1,4-diazepan-1-yl)-1-oxoethyl]amino]-3-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[[2-(1,4-diazepan-1-yl)acetyl]amino]-3-methylpentanoate Traditional Name: 2-[[2-(1,4-diazepan-1-yl)acetyl]amino]-3-methyl-valeric acid methyl ester Formula: C14H27N3O3 MolecularWeight: 285.38248

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC)NC(=O)CN1CCCNCC1

Isomeric SMILES

CCC(C)C(C(=O)OC)NC(=O)CN1CCCNCC1

InChI

InChI=1S/C14H27N3O3/c1-4-11(2)13(14(19)20-3)16-12(18)10-17-8-5-6-15-7-9-17/h11,13,15H,4-10H2,1-3H3,(H,16,18)