4-chloranyl-12-methylidene-5,6,7,8,9,10-hexahydroazepino[2,1-b]quinazolin-11-ium

Systemtic Name: 4-chloranyl-12-methylidene-5,6,7,8,9,10-hexahydroazepino[2,1-b]quinazolin-11-ium Openeye Name: 4-chloro-12-methylene-5,6,7,8,9,10-hexahydroazepino[2,1-b]quinazolin-11-ium CAS Name: 4-chloro-12-methylene-5,6,7,8,9,10-hexahydroazepino[2,1-b]quinazolin-11-ium IUPAC Name: 4-chloro-12-methylidene-5,6,7,8,9,10-hexahydroazepino[2,1-b]quinazolin-11-ium Traditional Name: 4-chloro-12-methylene-5,6,7,8,9,10-hexahydroazepino[2,1-b]quinazolin-11-ium Formula: C14H16ClN2+ MolecularWeight: 247.74324

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Descriptors Computed from Structure

Canonical SMILES:

C=C1C2=C(C(=CC=C2)Cl)NC3=[N+]1CCCCC3

Isomeric SMILES

C=C1C2=C(C(=CC=C2)Cl)NC3=[N+]1CCCCC3

InChI

InChI=1S/C14H15ClN2/c1-10-11-6-5-7-12(15)14(11)16-13-8-3-2-4-9-17(10)13/h5-7H,1-4,8-9H2/p+1