2-[[(ethylcarbamoylamino)-piperazin-1-yl-methylidene]amino]-4-methyl-pentanoic acid

Systemtic Name: 2-[[(ethylcarbamoylamino)-piperazin-1-yl-methylidene]amino]-4-methyl-pentanoic acid Openeye Name: 2-[[(ethylcarbamoylamino)-piperazin-1-yl-methylene]amino]-4-methyl-pentanoic acid CAS Name: 2-[[(ethylcarbamoylamino)-(1-piperazinyl)methylidene]amino]-4-methylpentanoic acid IUPAC Name: 2-[[(ethylcarbamoylamino)-piperazin-1-ylmethylidene]amino]-4-methylpentanoic acid Traditional Name: 2-[[(ethylcarbamoylamino)-piperazino-methylene]amino]-4-methyl-valeric acid Formula: C14H27N5O3 MolecularWeight: 313.39588

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC(=NC(CC(C)C)C(=O)O)N1CCNCC1

Isomeric SMILES

CCNC(=O)NC(=NC(CC(C)C)C(=O)O)N1CCNCC1

InChI

InChI=1S/C14H27N5O3/c1-4-16-14(22)18-13(19-7-5-15-6-8-19)17-11(12(20)21)9-10(2)3/h10-11,15H,4-9H2,1-3H3,(H,20,21)(H2,16,17,18,22)