[(1S)-2-methyl-1-(4-propylphenyl)propyl]-[(1R)-1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl]azanium

Systemtic Name: [(1S)-2-methyl-1-(4-propylphenyl)propyl]-[(1R)-1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl]azanium Openeye Name: [(1S)-2-methyl-1-(4-propylphenyl)propyl]-[(1R)-1-(4-oxo-1H-quinazolin-2-yl)ethyl]ammonium CAS Name: [(1S)-2-methyl-1-(4-propylphenyl)propyl]-[(1R)-1-(4-oxo-1H-quinazolin-2-yl)ethyl]ammonium IUPAC Name: [(1S)-2-methyl-1-(4-propylphenyl)propyl]-[(1R)-1-(4-oxo-1H-quinazolin-2-yl)ethyl]azanium Traditional Name: [(1R)-1-(4-keto-1H-quinazolin-2-yl)ethyl]-[(1S)-2-methyl-1-(4-propylphenyl)propyl]ammonium Formula: C23H30N3O+ MolecularWeight: 364.5038

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(C(C)C)[NH2+]C(C)C2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CCCC1=CC=C(C=C1)[C@H](C(C)C)[NH2+][C@H](C)C2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C23H29N3O/c1-5-8-17-11-13-18(14-12-17)21(15(2)3)24-16(4)22-25-20-10-7-6-9-19(20)23(27)26-22/h6-7,9-16,21,24H,5,8H2,1-4H3,(H,25,26,27)/p+1/t16-,21+/m1/s1