3-[[4-[ethyl-(1-methylindol-3-yl)amino]-4-oxidanylidene-2-propan-2-yl-butanoyl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 3-[[4-[ethyl-(1-methylindol-3-yl)amino]-4-oxidanylidene-2-propan-2-yl-butanoyl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 3-[[4-[ethyl-(1-methylindol-3-yl)amino]-2-isopropyl-4-oxo-butanoyl]amino]-4-oxo-butanoic acid CAS Name: 3-[[4-[ethyl-(1-methyl-3-indolyl)amino]-1,4-dioxo-2-propan-2-ylbutyl]amino]-4-oxobutanoic acid IUPAC Name: 3-[[4-[ethyl-(1-methylindol-3-yl)amino]-4-oxo-2-propan-2-ylbutanoyl]amino]-4-oxobutanoic acid Traditional Name: 3-[[4-[ethyl-(1-methylindol-3-yl)amino]-2-isopropyl-4-keto-butanoyl]amino]-4-keto-butyric acid Formula: C22H29N3O5 MolecularWeight: 415.48276

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CN(C2=CC=CC=C21)C)C(=O)CC(C(C)C)C(=O)NC(CC(=O)O)C=O

Isomeric SMILES

CCN(C1=CN(C2=CC=CC=C21)C)C(=O)CC(C(C)C)C(=O)NC(CC(=O)O)C=O

InChI

InChI=1S/C22H29N3O5/c1-5-25(19-12-24(4)18-9-7-6-8-16(18)19)20(27)11-17(14(2)3)22(30)23-15(13-26)10-21(28)29/h6-9,12-15,17H,5,10-11H2,1-4H3,(H,23,30)(H,28,29)