methyl 2-[[(2S)-2-azanyl-4-methyl-pentanoyl]amino]-2-(1,3-benzodioxol-5-yl)propanoate

Systemtic Name: methyl 2-[[(2S)-2-azanyl-4-methyl-pentanoyl]amino]-2-(1,3-benzodioxol-5-yl)propanoate Openeye Name: methyl 2-[[(2S)-2-amino-4-methyl-pentanoyl]amino]-2-(1,3-benzodioxol-5-yl)propanoate CAS Name: 2-[[(2S)-2-amino-4-methyl-1-oxopentyl]amino]-2-(1,3-benzodioxol-5-yl)propanoic acid methyl ester IUPAC Name: methyl 2-[[(2S)-2-amino-4-methylpentanoyl]amino]-2-(1,3-benzodioxol-5-yl)propanoate Traditional Name: 2-[[(2S)-2-amino-4-methyl-pentanoyl]amino]-2-(1,3-benzodioxol-5-yl)propionic acid methyl ester Formula: C17H24N2O5 MolecularWeight: 336.38286

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(C)(C1=CC2=C(C=C1)OCO2)C(=O)OC)N

Isomeric SMILES

CC(C)C[C@@H](C(=O)NC(C)(C1=CC2=C(C=C1)OCO2)C(=O)OC)N

InChI

InChI=1S/C17H24N2O5/c1-10(2)7-12(18)15(20)19-17(3,16(21)22-4)11-5-6-13-14(8-11)24-9-23-13/h5-6,8,10,12H,7,9,18H2,1-4H3,(H,19,20)/t12-,17?/m0/s1