ethyl (2S)-2-[bis(2-chloroethyl)carbamoylamino]-4-methyl-pentanoate

Systemtic Name: ethyl (2S)-2-[bis(2-chloroethyl)carbamoylamino]-4-methyl-pentanoate Openeye Name: ethyl (2S)-2-[bis(2-chloroethyl)carbamoylamino]-4-methyl-pentanoate CAS Name: (2S)-2-[[bis(2-chloroethyl)amino-oxomethyl]amino]-4-methylpentanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-[bis(2-chloroethyl)carbamoylamino]-4-methylpentanoate Traditional Name: (2S)-2-[bis(2-chloroethyl)carbamoylamino]-4-methyl-valeric acid ethyl ester Formula: C13H24Cl2N2O3 MolecularWeight: 327.24726

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(C)C)NC(=O)N(CCCl)CCCl

Isomeric SMILES

CCOC(=O)[C@H](CC(C)C)NC(=O)N(CCCl)CCCl

InChI

InChI=1S/C13H24Cl2N2O3/c1-4-20-12(18)11(9-10(2)3)16-13(19)17(7-5-14)8-6-15/h10-11H,4-9H2,1-3H3,(H,16,19)/t11-/m0/s1