furan-2-ylmethyl-[(1S)-1-[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]azanium

Systemtic Name: furan-2-ylmethyl-[(1S)-1-[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]azanium Openeye Name: 2-furylmethyl-[(1S)-1-[4-oxo-3-(p-tolyl)quinazolin-2-yl]ethyl]ammonium CAS Name: 2-furanylmethyl-[(1S)-1-[3-(4-methylphenyl)-4-oxo-2-quinazolinyl]ethyl]ammonium IUPAC Name: furan-2-ylmethyl-[(1S)-1-[3-(4-methylphenyl)-4-oxoquinazolin-2-yl]ethyl]azanium Traditional Name: 2-furfuryl-[(1S)-1-[4-keto-3-(p-tolyl)quinazolin-2-yl]ethyl]ammonium Formula: C22H22N3O2+ MolecularWeight: 360.42898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2C(C)[NH2+]CC4=CC=CO4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2[C@H](C)[NH2+]CC4=CC=CO4

InChI

InChI=1S/C22H21N3O2/c1-15-9-11-17(12-10-15)25-21(16(2)23-14-18-6-5-13-27-18)24-20-8-4-3-7-19(20)22(25)26/h3-13,16,23H,14H2,1-2H3/p+1/t16-/m0/s1