4-bromanyl-3-[3-[[3-methoxy-4-(2-pyrrolidin-1-ylethoxy)phenyl]amino]-5-methyl-1,2,4-benzotriazin-7-yl]phenol

Systemtic Name: 4-bromanyl-3-[3-[[3-methoxy-4-(2-pyrrolidin-1-ylethoxy)phenyl]amino]-5-methyl-1,2,4-benzotriazin-7-yl]phenol Openeye Name: 4-bromo-3-[3-[3-methoxy-4-(2-pyrrolidin-1-ylethoxy)anilino]-5-methyl-1,2,4-benzotriazin-7-yl]phenol CAS Name: 4-bromo-3-[3-[3-methoxy-4-[2-(1-pyrrolidinyl)ethoxy]anilino]-5-methyl-1,2,4-benzotriazin-7-yl]phenol IUPAC Name: 4-bromo-3-[3-[3-methoxy-4-(2-pyrrolidin-1-ylethoxy)anilino]-5-methyl-1,2,4-benzotriazin-7-yl]phenol Traditional Name: 4-bromo-3-[3-[3-methoxy-4-(2-pyrrolidinoethoxy)anilino]-5-methyl-1,2,4-benzotriazin-7-yl]phenol Formula: C27H28BrN5O3 MolecularWeight: 550.44692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)C3=C(C=CC(=C3)O)Br)N=NC(=N2)NC4=CC(=C(C=C4)OCCN5CCCC5)OC

Isomeric SMILES

CC1=C2C(=CC(=C1)C3=C(C=CC(=C3)O)Br)N=NC(=N2)NC4=CC(=C(C=C4)OCCN5CCCC5)OC

InChI

InChI=1S/C27H28BrN5O3/c1-17-13-18(21-16-20(34)6-7-22(21)28)14-23-26(17)30-27(32-31-23)29-19-5-8-24(25(15-19)35-2)36-12-11-33-9-3-4-10-33/h5-8,13-16,34H,3-4,9-12H2,1-2H3,(H,29,30,32)