1-[2-(2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl)ethyl]-2,3,3a,4,5,6,7,7a-octahydro-1H-indene; 4-azanylbenzoic acid; titanium(2+)

Systemtic Name: 1-[2-(2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl)ethyl]-2,3,3a,4,5,6,7,7a-octahydro-1H-indene; 4-azanylbenzoic acid; titanium(2+) Openeye Name: 1-[2-(2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl)ethyl]-2,3,3a,4,5,6,7,7a-octahydro-1H-indene; 4-aminobenzoic acid; titanium(2+) CAS Name: 1-[2-(2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl)ethyl]-2,3,3a,4,5,6,7,7a-octahydro-1H-indene; 4-aminobenzoic acid; titanium(2+) IUPAC Name: 1-[2-(2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl)ethyl]-2,3,3a,4,5,6,7,7a-octahydro-1H-indene; 4-aminobenzoic acid; titanium(2+) Traditional Name: 1-[2-(2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl)ethyl]-2,3,3a,4,5,6,7,7a-octahydro-1H-indene; 4-aminobenzoic acid; titanium(2+) Formula: C34H48N2O4Ti+2 MolecularWeight: 596.62292

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2C(C1)CCC2CCC3CCC4C3CCCC4.C1=CC(=CC=C1C(=O)O)N.C1=CC(=CC=C1C(=O)O)N.[Ti+2]

Isomeric SMILES

C1CCC2C(C1)CCC2CCC3CCC4C3CCCC4.C1=CC(=CC=C1C(=O)O)N.C1=CC(=CC=C1C(=O)O)N.[Ti+2]

InChI

InChI=1S/C20H34.2C7H7NO2.Ti/c1-3-7-19-15(5-1)9-11-17(19)13-14-18-12-10-16-6-2-4-8-20(16)18;2*8-6-3-1-5(2-4-6)7(9)10;/h15-20H,1-14H2;2*1-4H,8H2,(H,9,10);/q;;;+2