4-[(1-azanyl-4-chloranyl-1H-phthalazin-2-yl)methyl]-2,6-bis(pyrrolidin-1-ylmethyl)phenol

Systemtic Name: 4-[(1-azanyl-4-chloranyl-1H-phthalazin-2-yl)methyl]-2,6-bis(pyrrolidin-1-ylmethyl)phenol Openeye Name: 4-[(1-amino-4-chloro-1H-phthalazin-2-yl)methyl]-2,6-bis(pyrrolidin-1-ylmethyl)phenol CAS Name: 4-[(1-amino-4-chloro-1H-phthalazin-2-yl)methyl]-2,6-bis(1-pyrrolidinylmethyl)phenol IUPAC Name: 4-[(1-amino-4-chloro-1H-phthalazin-2-yl)methyl]-2,6-bis(pyrrolidin-1-ylmethyl)phenol Traditional Name: 4-[(1-amino-4-chloro-1H-phthalazin-2-yl)methyl]-2,6-bis(pyrrolidinomethyl)phenol Formula: C25H32ClN5O MolecularWeight: 454.00748

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC(=CC(=C2O)CN3CCCC3)CN4C(C5=CC=CC=C5C(=N4)Cl)N

Isomeric SMILES

C1CCN(C1)CC2=CC(=CC(=C2O)CN3CCCC3)CN4C(C5=CC=CC=C5C(=N4)Cl)N

InChI

InChI=1S/C25H32ClN5O/c26-24-21-7-1-2-8-22(21)25(27)31(28-24)15-18-13-19(16-29-9-3-4-10-29)23(32)20(14-18)17-30-11-5-6-12-30/h1-2,7-8,13-14,25,32H,3-6,9-12,15-17,27H2