N-[(E)-anthracen-9-ylmethylideneamino]-3,4,5,6-tetrahydro-2H-azepin-7-amine hydrochloride

Systemtic Name: N-[(E)-anthracen-9-ylmethylideneamino]-3,4,5,6-tetrahydro-2H-azepin-7-amine hydrochloride Openeye Name: N-[(E)-9-anthrylmethyleneamino]-3,4,5,6-tetrahydro-2H-azepin-7-amine hydrochloride CAS Name: N-[(E)-9-anthracenylmethylideneamino]-3,4,5,6-tetrahydro-2H-azepin-7-amine hydrochloride IUPAC Name: N-[(E)-anthracen-9-ylmethylideneamino]-3,4,5,6-tetrahydro-2H-azepin-7-amine hydrochloride Traditional Name: [(E)-9-anthrylmethyleneamino]-(3,4,5,6-tetrahydro-2H-azepin-7-yl)amine hydrochloride Formula: C21H22ClN3 MolecularWeight: 351.87248

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=NCC1)NN=CC2=C3C=CC=CC3=CC4=CC=CC=C42.Cl

Isomeric SMILES

C1CCC(=NCC1)N/N=C/C2=C3C=CC=CC3=CC4=CC=CC=C42.Cl

InChI

InChI=1S/C21H21N3.ClH/c1-2-12-21(22-13-7-1)24-23-15-20-18-10-5-3-8-16(18)14-17-9-4-6-11-19(17)20;/h3-6,8-11,14-15H,1-2,7,12-13H2,(H,22,24);1H/b23-15+;