1,1-bis(4-sulfonyl-2,8b-dihydro-1H-acenaphthylen-5-yl)guanidine

Systemtic Name: 1,1-bis(4-sulfonyl-2,8b-dihydro-1H-acenaphthylen-5-yl)guanidine Openeye Name: 1,1-bis(4-sulfonyl-2,8b-dihydro-1H-acenaphthylen-5-yl)guanidine CAS Name: 1,1-bis(4-sulfonyl-2,8b-dihydro-1H-acenaphthylen-5-yl)guanidine IUPAC Name: 1,1-bis(4-sulfonyl-2,8b-dihydro-1H-acenaphthylen-5-yl)guanidine Traditional Name: 1,1-bis(4-sulfonyl-2,8b-dihydro-1H-acenaphthylen-5-yl)guanidine Formula: C25H21N3O4S2 MolecularWeight: 491.58194

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC(=S(=O)=O)C(=C3C2C1=CC=C3)N(C4=C5C=CC=C6C5C(=CC4=S(=O)=O)CC6)C(=N)N

Isomeric SMILES

C1CC2=CC(=S(=O)=O)C(=C3C2C1=CC=C3)N(C4=C5C=CC=C6C5C(=CC4=S(=O)=O)CC6)C(=N)N

InChI

InChI=1S/C25H21N3O4S2/c26-25(27)28(23-17-5-1-3-13-7-9-15(21(13)17)11-19(23)33(29)30)24-18-6-2-4-14-8-10-16(22(14)18)12-20(24)34(31)32/h1-6,11-12,21-22H,7-10H2,(H3,26,27)