4-[(4-chloranyl-2,3-dihydrophthalazin-1-yl)imino]-2,6-bis(pyrrolidin-1-ylmethyl)cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[(4-chloranyl-2,3-dihydrophthalazin-1-yl)imino]-2,6-bis(pyrrolidin-1-ylmethyl)cyclohexa-2,5-dien-1-one Openeye Name: 4-[(4-chloro-2,3-dihydrophthalazin-1-yl)imino]-2,6-bis(pyrrolidin-1-ylmethyl)cyclohexa-2,5-dien-1-one CAS Name: 4-[(4-chloro-2,3-dihydrophthalazin-1-yl)imino]-2,6-bis(1-pyrrolidinylmethyl)-1-cyclohexa-2,5-dienone IUPAC Name: 4-[(4-chloro-2,3-dihydrophthalazin-1-yl)imino]-2,6-bis(pyrrolidin-1-ylmethyl)cyclohexa-2,5-dien-1-one Traditional Name: 4-[(4-chloro-2,3-dihydrophthalazin-1-yl)imino]-2,6-bis(pyrrolidinomethyl)cyclohexa-2,5-dien-1-one Formula: C24H28ClN5O MolecularWeight: 437.96502

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC(=NC3=C4C=CC=CC4=C(NN3)Cl)C=C(C2=O)CN5CCCC5

Isomeric SMILES

C1CCN(C1)CC2=CC(=NC3=C4C=CC=CC4=C(NN3)Cl)C=C(C2=O)CN5CCCC5

InChI

InChI=1S/C24H28ClN5O/c25-23-20-7-1-2-8-21(20)24(28-27-23)26-19-13-17(15-29-9-3-4-10-29)22(31)18(14-19)16-30-11-5-6-12-30/h1-2,7-8,13-14,27-28H,3-6,9-12,15-16H2