3-azanyl-4-[[3-methyl-1-oxidanylidene-1-(1-phenylpropylamino)butan-2-yl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 3-azanyl-4-[[3-methyl-1-oxidanylidene-1-(1-phenylpropylamino)butan-2-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 3-amino-4-[[2-methyl-1-(1-phenylpropylcarbamoyl)propyl]amino]-4-oxo-butanoic acid CAS Name: 3-amino-4-[[3-methyl-1-oxo-1-(1-phenylpropylamino)butan-2-yl]amino]-4-oxobutanoic acid IUPAC Name: 3-amino-4-[[3-methyl-1-oxo-1-(1-phenylpropylamino)butan-2-yl]amino]-4-oxobutanoic acid Traditional Name: 3-amino-4-keto-4-[[2-methyl-1-(1-phenylpropylcarbamoyl)propyl]amino]butyric acid Formula: C18H27N3O4 MolecularWeight: 349.42468

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)NC(=O)C(C(C)C)NC(=O)C(CC(=O)O)N

Isomeric SMILES

CCC(C1=CC=CC=C1)NC(=O)C(C(C)C)NC(=O)C(CC(=O)O)N

InChI

InChI=1S/C18H27N3O4/c1-4-14(12-8-6-5-7-9-12)20-18(25)16(11(2)3)21-17(24)13(19)10-15(22)23/h5-9,11,13-14,16H,4,10,19H2,1-3H3,(H,20,25)(H,21,24)(H,22,23)