2-(1,3-benzodioxol-5-ylmethyl)-1-(1,2-dihydroacenaphthylen-5-yl)-1-methyl-guanidine

Systemtic Name: 2-(1,3-benzodioxol-5-ylmethyl)-1-(1,2-dihydroacenaphthylen-5-yl)-1-methyl-guanidine Openeye Name: 2-(1,3-benzodioxol-5-ylmethyl)-1-(1,2-dihydroacenaphthylen-5-yl)-1-methyl-guanidine CAS Name: 2-(1,3-benzodioxol-5-ylmethyl)-1-(1,2-dihydroacenaphthylen-5-yl)-1-methylguanidine IUPAC Name: 2-(1,3-benzodioxol-5-ylmethyl)-1-(1,2-dihydroacenaphthylen-5-yl)-1-methylguanidine Traditional Name: 1-acenaphthen-5-yl-1-methyl-2-piperonyl-guanidine Formula: C22H21N3O2 MolecularWeight: 359.42104

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=C2C=CC=C3C2=C(CC3)C=C1)C(=NCC4=CC5=C(C=C4)OCO5)N

Isomeric SMILES

CN(C1=C2C=CC=C3C2=C(CC3)C=C1)C(=NCC4=CC5=C(C=C4)OCO5)N

InChI

InChI=1S/C22H21N3O2/c1-25(18-9-8-16-7-6-15-3-2-4-17(18)21(15)16)22(23)24-12-14-5-10-19-20(11-14)27-13-26-19/h2-5,8-11H,6-7,12-13H2,1H3,(H2,23,24)