2-[(3-oxidanylidenebenzo[f]chromen-1-yl)methylazaniumyl]ethyl-di(propan-2-yl)azanium

Systemtic Name: 2-[(3-oxidanylidenebenzo[f]chromen-1-yl)methylazaniumyl]ethyl-di(propan-2-yl)azanium Openeye Name: diisopropyl-[2-[(3-oxobenzo[f]chromen-1-yl)methylammonio]ethyl]ammonium CAS Name: 2-[(3-oxo-1-benzo[f][1]benzopyranyl)methylammonio]ethyl-di(propan-2-yl)ammonium IUPAC Name: 2-[(3-oxobenzo[f]chromen-1-yl)methylazaniumyl]ethyl-di(propan-2-yl)azanium Traditional Name: diisopropyl-[2-[(3-ketobenzo[f]chromen-1-yl)methylammonio]ethyl]ammonium Formula: C22H30N2O2+2 MolecularWeight: 354.4858

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](CC[NH2+]CC1=CC(=O)OC2=C1C3=CC=CC=C3C=C2)C(C)C

Isomeric SMILES

CC(C)[NH+](CC[NH2+]CC1=CC(=O)OC2=C1C3=CC=CC=C3C=C2)C(C)C

InChI

InChI=1S/C22H28N2O2/c1-15(2)24(16(3)4)12-11-23-14-18-13-21(25)26-20-10-9-17-7-5-6-8-19(17)22(18)20/h5-10,13,15-16,23H,11-12,14H2,1-4H3/p+2