(2S)-2-[(3-chloranyl-4-methoxy-phenyl)carbamoylamino]-4-methyl-pentanoate

Systemtic Name: (2S)-2-[(3-chloranyl-4-methoxy-phenyl)carbamoylamino]-4-methyl-pentanoate Openeye Name: (2S)-2-[(3-chloro-4-methoxy-phenyl)carbamoylamino]-4-methyl-pentanoate CAS Name: (2S)-2-[[(3-chloro-4-methoxyanilino)-oxomethyl]amino]-4-methylpentanoate IUPAC Name: (2S)-2-[(3-chloro-4-methoxyphenyl)carbamoylamino]-4-methylpentanoate Traditional Name: (2S)-2-[(3-chloro-4-methoxy-phenyl)carbamoylamino]-4-methyl-valerate Formula: C14H18ClN2O4- MolecularWeight: 313.75672

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)[O-])NC(=O)NC1=CC(=C(C=C1)OC)Cl

Isomeric SMILES

CC(C)C[C@@H](C(=O)[O-])NC(=O)NC1=CC(=C(C=C1)OC)Cl

InChI

InChI=1S/C14H19ClN2O4/c1-8(2)6-11(13(18)19)17-14(20)16-9-4-5-12(21-3)10(15)7-9/h4-5,7-8,11H,6H2,1-3H3,(H,18,19)(H2,16,17,20)/p-1/t11-/m0/s1