(2R)-3-(1H-indol-3-yl)-2-[(2-propan-2-ylquinazolin-4-yl)azaniumyl]propanoate

Systemtic Name: (2R)-3-(1H-indol-3-yl)-2-[(2-propan-2-ylquinazolin-4-yl)azaniumyl]propanoate Openeye Name: (2R)-3-(1H-indol-3-yl)-2-[(2-isopropylquinazolin-4-yl)ammonio]propanoate CAS Name: (2R)-3-(1H-indol-3-yl)-2-[(2-propan-2-yl-4-quinazolinyl)ammonio]propanoate IUPAC Name: (2R)-3-(1H-indol-3-yl)-2-[(2-propan-2-ylquinazolin-4-yl)azaniumyl]propanoate Traditional Name: (2R)-3-(1H-indol-3-yl)-2-[(2-isopropylquinazolin-4-yl)ammonio]propionate Formula: C22H22N4O2 MolecularWeight: 374.43568

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=CC=CC=C2C(=N1)[NH2+]C(CC3=CNC4=CC=CC=C43)C(=O)[O-]

Isomeric SMILES

CC(C)C1=NC2=CC=CC=C2C(=N1)[NH2+][C@H](CC3=CNC4=CC=CC=C43)C(=O)[O-]

InChI

InChI=1S/C22H22N4O2/c1-13(2)20-24-18-10-6-4-8-16(18)21(26-20)25-19(22(27)28)11-14-12-23-17-9-5-3-7-15(14)17/h3-10,12-13,19,23H,11H2,1-2H3,(H,27,28)(H,24,25,26)/t19-/m1/s1