2-[(4-aminophenyl)methyl]-2,3,4,9-tetrahydro-1H-pyrazino[2,3-d]azepin-7-ium-7-amine

Systemtic Name: 2-[(4-aminophenyl)methyl]-2,3,4,9-tetrahydro-1H-pyrazino[2,3-d]azepin-7-ium-7-amine Openeye Name: 2-[(4-aminophenyl)methyl]-2,3,4,9-tetrahydro-1H-pyrazino[2,3-d]azepin-7-ium-7-amine CAS Name: 2-[(4-aminophenyl)methyl]-2,3,4,9-tetrahydro-1H-pyrazino[2,3-d]azepin-7-ium-7-amine IUPAC Name: 2-[(4-aminophenyl)methyl]-2,3,4,9-tetrahydro-1H-pyrazino[2,3-d]azepin-7-ium-7-amine Traditional Name: [2-(4-aminobenzyl)-2,3,4,9-tetrahydro-1H-pyrazin[2,3-d]azepin-7-ium-7-yl]amine Formula: C15H20N5+ MolecularWeight: 270.3528

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Descriptors Computed from Structure

Canonical SMILES:

C1C=[N+](C=CC2=C1NC(CN2)CC3=CC=C(C=C3)N)N

Isomeric SMILES

C1C=[N+](C=CC2=C1NC(CN2)CC3=CC=C(C=C3)N)N

InChI

InChI=1S/C15H20N5/c16-12-3-1-11(2-4-12)9-13-10-18-14-5-7-20(17)8-6-15(14)19-13/h1-5,7-8,13,18-19H,6,9-10,16-17H2/q+1