4-[2-[4-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]phenyl]ethyl]-N'-phenethyl-benzenecarboximidamide hydrochloride

Systemtic Name: 4-[2-[4-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]phenyl]ethyl]-N'-phenethyl-benzenecarboximidamide hydrochloride Openeye Name: 4-[2-[4-[(1,3-dioxoisoindolin-2-yl)methyl]phenyl]ethyl]-N'-phenethyl-benzamidine hydrochloride CAS Name: 4-[2-[4-[(1,3-dioxo-2-isoindolyl)methyl]phenyl]ethyl]-N'-phenethylbenzenecarboximidamide hydrochloride IUPAC Name: 4-[2-[4-[(1,3-dioxoisoindol-2-yl)methyl]phenyl]ethyl]-N'-phenethylbenzenecarboximidamide hydrochloride Traditional Name: N'-phenethyl-4-[2-[4-(phthalimidomethyl)phenyl]ethyl]benzamidine hydrochloride Formula: C32H30ClN3O2 MolecularWeight: 524.0525

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN=C(C2=CC=C(C=C2)CCC3=CC=C(C=C3)CN4C(=O)C5=CC=CC=C5C4=O)N.Cl

Isomeric SMILES

C1=CC=C(C=C1)CCN=C(C2=CC=C(C=C2)CCC3=CC=C(C=C3)CN4C(=O)C5=CC=CC=C5C4=O)N.Cl

InChI

InChI=1S/C32H29N3O2.ClH/c33-30(34-21-20-23-6-2-1-3-7-23)27-18-16-25(17-19-27)11-10-24-12-14-26(15-13-24)22-35-31(36)28-8-4-5-9-29(28)32(35)37;/h1-9,12-19H,10-11,20-22H2,(H2,33,34);1H