5-azanylidene-N-[(4-chlorophenyl)methyl]-N-propyl-1-oxa-3-azonia-2-azanidacyclopent-3-en-3-amine

Systemtic Name: 5-azanylidene-N-[(4-chlorophenyl)methyl]-N-propyl-1-oxa-3-azonia-2-azanidacyclopent-3-en-3-amine Openeye Name: N-[(4-chlorophenyl)methyl]-5-imino-N-propyl-1-oxa-3-azonia-2-azanidacyclopent-3-en-3-amine CAS Name: N-[(4-chlorophenyl)methyl]-5-imino-N-propyl-1-oxa-3-azonia-2-azanidacyclopent-3-en-3-amine IUPAC Name: N-[(4-chlorophenyl)methyl]-5-imino-N-propyl-1-oxa-3-azonia-2-azanidacyclopent-3-en-3-amine Traditional Name: (4-chlorobenzyl)-(5-imino-1-oxa-3-azonia-2-azanidacyclopent-3-en-3-yl)-propyl-amine Formula: C12H15ClN4O MolecularWeight: 266.7267

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC=C(C=C1)Cl)[N+]2=CC(=N)O[N-]2

Isomeric SMILES

CCCN(CC1=CC=C(C=C1)Cl)[N+]2=CC(=N)O[N-]2

InChI

InChI=1S/C12H15ClN4O/c1-2-7-16(17-9-12(14)18-15-17)8-10-3-5-11(13)6-4-10/h3-6,9,14H,2,7-8H2,1H3