(2R)-3-(1H-indol-3-yl)-2-[(7-methoxyquinazolin-4-yl)azaniumyl]propanoate

Systemtic Name: (2R)-3-(1H-indol-3-yl)-2-[(7-methoxyquinazolin-4-yl)azaniumyl]propanoate Openeye Name: (2R)-3-(1H-indol-3-yl)-2-[(7-methoxyquinazolin-4-yl)ammonio]propanoate CAS Name: (2R)-3-(1H-indol-3-yl)-2-[(7-methoxy-4-quinazolinyl)ammonio]propanoate IUPAC Name: (2R)-3-(1H-indol-3-yl)-2-[(7-methoxyquinazolin-4-yl)azaniumyl]propanoate Traditional Name: (2R)-3-(1H-indol-3-yl)-2-[(7-methoxyquinazolin-4-yl)ammonio]propionate Formula: C20H18N4O3 MolecularWeight: 362.38192

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=NC=N2)[NH2+]C(CC3=CNC4=CC=CC=C43)C(=O)[O-]

Isomeric SMILES

COC1=CC2=C(C=C1)C(=NC=N2)[NH2+][C@H](CC3=CNC4=CC=CC=C43)C(=O)[O-]

InChI

InChI=1S/C20H18N4O3/c1-27-13-6-7-15-17(9-13)22-11-23-19(15)24-18(20(25)26)8-12-10-21-16-5-3-2-4-14(12)16/h2-7,9-11,18,21H,8H2,1H3,(H,25,26)(H,22,23,24)/t18-/m1/s1