2-cyclohexyl-3-(4-ethylpiperazin-1-yl)-3H-isoindol-1-one; 1-phenyl-N-(phenylmethyl)methanamine

Systemtic Name: 2-cyclohexyl-3-(4-ethylpiperazin-1-yl)-3H-isoindol-1-one; 1-phenyl-N-(phenylmethyl)methanamine Openeye Name: N-benzyl-1-phenyl-methanamine; 2-cyclohexyl-3-(4-ethylpiperazin-1-yl)isoindolin-1-one CAS Name: 2-cyclohexyl-3-(4-ethyl-1-piperazinyl)-3H-isoindol-1-one; 1-phenyl-N-(phenylmethyl)methanamine IUPAC Name: N-benzyl-1-phenylmethanamine; 2-cyclohexyl-3-(4-ethylpiperazin-1-yl)-3H-isoindol-1-one Traditional Name: 2-cyclohexyl-3-(4-ethylpiperazino)isoindolin-1-one; dibenzylamine Formula: C34H44N4O MolecularWeight: 524.73936

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2C3=CC=CC=C3C(=O)N2C4CCCCC4.C1=CC=C(C=C1)CNCC2=CC=CC=C2

Isomeric SMILES

CCN1CCN(CC1)C2C3=CC=CC=C3C(=O)N2C4CCCCC4.C1=CC=C(C=C1)CNCC2=CC=CC=C2

InChI

InChI=1S/C20H29N3O.C14H15N/c1-2-21-12-14-22(15-13-21)19-17-10-6-7-11-18(17)20(24)23(19)16-8-4-3-5-9-16;1-3-7-13(8-4-1)11-15-12-14-9-5-2-6-10-14/h6-7,10-11,16,19H,2-5,8-9,12-15H2,1H3;1-10,15H,11-12H2