5-chloranyl-2-[[4-[2-oxidanyl-3-(propan-2-ylamino)propoxy]phenyl]amino]cyclohepta-2,4,6-trien-1-one

Systemtic Name: 5-chloranyl-2-[[4-[2-oxidanyl-3-(propan-2-ylamino)propoxy]phenyl]amino]cyclohepta-2,4,6-trien-1-one Openeye Name: 5-chloro-2-[4-[2-hydroxy-3-(isopropylamino)propoxy]anilino]cyclohepta-2,4,6-trien-1-one CAS Name: 5-chloro-2-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]anilino]-1-cyclohepta-2,4,6-trienone IUPAC Name: 5-chloro-2-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]anilino]cyclohepta-2,4,6-trien-1-one Traditional Name: 5-chloro-2-[4-[2-hydroxy-3-(isopropylamino)propoxy]anilino]cyclohepta-2,4,6-trien-1-one Formula: C19H23ClN2O3 MolecularWeight: 362.85052

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC(COC1=CC=C(C=C1)NC2=CC=C(C=CC2=O)Cl)O

Isomeric SMILES

CC(C)NCC(COC1=CC=C(C=C1)NC2=CC=C(C=CC2=O)Cl)O

InChI

InChI=1S/C19H23ClN2O3/c1-13(2)21-11-16(23)12-25-17-7-5-15(6-8-17)22-18-9-3-14(20)4-10-19(18)24/h3-10,13,16,21,23H,11-12H2,1-2H3,(H,22,24)