3-[[4-methyl-2-[2-(naphthalen-1-ylamino)propanoylamino]pentanoyl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 3-[[4-methyl-2-[2-(naphthalen-1-ylamino)propanoylamino]pentanoyl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 3-[[4-methyl-2-[2-(1-naphthylamino)propanoylamino]pentanoyl]amino]-4-oxo-butanoic acid CAS Name: 3-[[4-methyl-2-[[2-(1-naphthalenylamino)-1-oxopropyl]amino]-1-oxopentyl]amino]-4-oxobutanoic acid IUPAC Name: 3-[[4-methyl-2-[2-(naphthalen-1-ylamino)propanoylamino]pentanoyl]amino]-4-oxobutanoic acid Traditional Name: 4-keto-3-[[4-methyl-2-[2-(1-naphthylamino)propanoylamino]pentanoyl]amino]butyric acid Formula: C23H29N3O5 MolecularWeight: 427.49346

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CC(=O)O)C=O)NC(=O)C(C)NC1=CC=CC2=CC=CC=C21

Isomeric SMILES

CC(C)CC(C(=O)NC(CC(=O)O)C=O)NC(=O)C(C)NC1=CC=CC2=CC=CC=C21

InChI

InChI=1S/C23H29N3O5/c1-14(2)11-20(23(31)25-17(13-27)12-21(28)29)26-22(30)15(3)24-19-10-6-8-16-7-4-5-9-18(16)19/h4-10,13-15,17,20,24H,11-12H2,1-3H3,(H,25,31)(H,26,30)(H,28,29)