[(1S)-1-(7-chloranyl-3-ethyl-4-oxidanylidene-quinazolin-2-yl)ethyl]-(phenylmethyl)azanium

Systemtic Name: [(1S)-1-(7-chloranyl-3-ethyl-4-oxidanylidene-quinazolin-2-yl)ethyl]-(phenylmethyl)azanium Openeye Name: benzyl-[(1S)-1-(7-chloro-3-ethyl-4-oxo-quinazolin-2-yl)ethyl]ammonium CAS Name: [(1S)-1-(7-chloro-3-ethyl-4-oxo-2-quinazolinyl)ethyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-[(1S)-1-(7-chloro-3-ethyl-4-oxoquinazolin-2-yl)ethyl]azanium Traditional Name: benzyl-[(1S)-1-(7-chloro-3-ethyl-4-keto-quinazolin-2-yl)ethyl]ammonium Formula: C19H21ClN3O+ MolecularWeight: 342.84254

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1C(C)[NH2+]CC3=CC=CC=C3

Isomeric SMILES

CCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1[C@H](C)[NH2+]CC3=CC=CC=C3

InChI

InChI=1S/C19H20ClN3O/c1-3-23-18(13(2)21-12-14-7-5-4-6-8-14)22-17-11-15(20)9-10-16(17)19(23)24/h4-11,13,21H,3,12H2,1-2H3/p+1/t13-/m0/s1