N1,N4-bis(3,4,5,6-tetrahydro-2H-azepin-1-ium-7-yl)benzene-1,4-diamine

Systemtic Name: N1,N4-bis(3,4,5,6-tetrahydro-2H-azepin-1-ium-7-yl)benzene-1,4-diamine Openeye Name: N1,N4-bis(3,4,5,6-tetrahydro-2H-azepin-1-ium-7-yl)benzene-1,4-diamine CAS Name: N1,N4-bis(3,4,5,6-tetrahydro-2H-azepin-1-ium-7-yl)benzene-1,4-diamine IUPAC Name: 1-N,4-N-bis(3,4,5,6-tetrahydro-2H-azepin-1-ium-7-yl)benzene-1,4-diamine Traditional Name: 3,4,5,6-tetrahydro-2H-azepin-1-ium-7-yl-[4-(3,4,5,6-tetrahydro-2H-azepin-1-ium-7-ylamino)phenyl]amine Formula: C18H28N4+2 MolecularWeight: 300.44172

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=[NH+]CC1)NC2=CC=C(C=C2)NC3=[NH+]CCCCC3

Isomeric SMILES

C1CCC(=[NH+]CC1)NC2=CC=C(C=C2)NC3=[NH+]CCCCC3

InChI

InChI=1S/C18H26N4/c1-3-7-17(19-13-5-1)21-15-9-11-16(12-10-15)22-18-8-4-2-6-14-20-18/h9-12H,1-8,13-14H2,(H,19,21)(H,20,22)/p+2