5-[[2-[(4-hydroxyphenyl)-propan-2-yl-amino]-2-oxidanylidene-ethyl]-phenyl-amino]-5-oxidanylidene-4-(phenylcarbamoylamino)pentanoic acid

Systemtic Name: 5-[[2-[(4-hydroxyphenyl)-propan-2-yl-amino]-2-oxidanylidene-ethyl]-phenyl-amino]-5-oxidanylidene-4-(phenylcarbamoylamino)pentanoic acid Openeye Name: 5-(N-[2-(4-hydroxy-N-isopropyl-anilino)-2-oxo-ethyl]anilino)-5-oxo-4-(phenylcarbamoylamino)pentanoic acid CAS Name: 4-[[anilino(oxo)methyl]amino]-5-(N-[2-(4-hydroxy-N-propan-2-ylanilino)-2-oxoethyl]anilino)-5-oxopentanoic acid IUPAC Name: 5-(N-[2-(4-hydroxy-N-propan-2-ylanilino)-2-oxoethyl]anilino)-5-oxo-4-(phenylcarbamoylamino)pentanoic acid Traditional Name: 5-(N-[2-(4-hydroxy-N-isopropyl-anilino)-2-keto-ethyl]anilino)-5-keto-4-(phenylcarbamoylamino)valeric acid Formula: C29H32N4O6 MolecularWeight: 532.58758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C1=CC=C(C=C1)O)C(=O)CN(C2=CC=CC=C2)C(=O)C(CCC(=O)O)NC(=O)NC3=CC=CC=C3

Isomeric SMILES

CC(C)N(C1=CC=C(C=C1)O)C(=O)CN(C2=CC=CC=C2)C(=O)C(CCC(=O)O)NC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C29H32N4O6/c1-20(2)33(23-13-15-24(34)16-14-23)26(35)19-32(22-11-7-4-8-12-22)28(38)25(17-18-27(36)37)31-29(39)30-21-9-5-3-6-10-21/h3-16,20,25,34H,17-19H2,1-2H3,(H,36,37)(H2,30,31,39)