3-[[6-methyl-7-(4-oxidanyl-3-propan-2-yl-phenoxy)-2,3-dihydro-1H-inden-4-yl]amino]-3-oxidanylidene-propanoic acid

Systemtic Name: 3-[[6-methyl-7-(4-oxidanyl-3-propan-2-yl-phenoxy)-2,3-dihydro-1H-inden-4-yl]amino]-3-oxidanylidene-propanoic acid Openeye Name: 3-[[7-(4-hydroxy-3-isopropyl-phenoxy)-6-methyl-indan-4-yl]amino]-3-oxo-propanoic acid CAS Name: 3-[[7-(4-hydroxy-3-propan-2-ylphenoxy)-6-methyl-2,3-dihydro-1H-inden-4-yl]amino]-3-oxopropanoic acid IUPAC Name: 3-[[7-(4-hydroxy-3-propan-2-ylphenoxy)-6-methyl-2,3-dihydro-1H-inden-4-yl]amino]-3-oxopropanoic acid Traditional Name: 3-[[7-(4-hydroxy-3-isopropyl-phenoxy)-6-methyl-indan-4-yl]amino]-3-keto-propionic acid Formula: C22H25NO5 MolecularWeight: 383.4376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2CCCC2=C1OC3=CC(=C(C=C3)O)C(C)C)NC(=O)CC(=O)O

Isomeric SMILES

CC1=CC(=C2CCCC2=C1OC3=CC(=C(C=C3)O)C(C)C)NC(=O)CC(=O)O

InChI

InChI=1S/C22H25NO5/c1-12(2)17-10-14(7-8-19(17)24)28-22-13(3)9-18(15-5-4-6-16(15)22)23-20(25)11-21(26)27/h7-10,12,24H,4-6,11H2,1-3H3,(H,23,25)(H,26,27)