N-butyl-7-phenyl-2,3-dihydro-1H-1,4-diazepin-5-amine; perchloric acid

Systemtic Name: N-butyl-7-phenyl-2,3-dihydro-1H-1,4-diazepin-5-amine; perchloric acid Openeye Name: N-butyl-7-phenyl-2,3-dihydro-1H-1,4-diazepin-5-amine; perchloric acid CAS Name: N-butyl-7-phenyl-2,3-dihydro-1H-1,4-diazepin-5-amine; perchloric acid IUPAC Name: N-butyl-7-phenyl-2,3-dihydro-1H-1,4-diazepin-5-amine; perchloric acid Traditional Name: butyl-(7-phenyl-2,3-dihydro-1H-1,4-diazepin-5-yl)amine; perchloric acid Formula: C15H22ClN3O4 MolecularWeight: 343.80588

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NCCNC(=C1)C2=CC=CC=C2.OCl(=O)(=O)=O

Isomeric SMILES

CCCCNC1=NCCNC(=C1)C2=CC=CC=C2.OCl(=O)(=O)=O

InChI

InChI=1S/C15H21N3.ClHO4/c1-2-3-9-17-15-12-14(16-10-11-18-15)13-7-5-4-6-8-13;2-1(3,4)5/h4-8,12,16H,2-3,9-11H2,1H3,(H,17,18);(H,2,3,4,5)