phenanthridin-6-ylmethyl 3-(3-cyclopropyl-4-oxidanylidene-quinazolin-2-yl)propanoate

Systemtic Name: phenanthridin-6-ylmethyl 3-(3-cyclopropyl-4-oxidanylidene-quinazolin-2-yl)propanoate Openeye Name: phenanthridin-6-ylmethyl 3-(3-cyclopropyl-4-oxo-quinazolin-2-yl)propanoate CAS Name: 3-(3-cyclopropyl-4-oxo-2-quinazolinyl)propanoic acid 6-phenanthridinylmethyl ester IUPAC Name: phenanthridin-6-ylmethyl 3-(3-cyclopropyl-4-oxoquinazolin-2-yl)propanoate Traditional Name: 3-(3-cyclopropyl-4-keto-quinazolin-2-yl)propionic acid phenanthridin-6-ylmethyl ester Formula: C28H23N3O3 MolecularWeight: 449.50052

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NC3=CC=CC=C3C2=O)CCC(=O)OCC4=NC5=CC=CC=C5C6=CC=CC=C64

Isomeric SMILES

C1CC1N2C(=NC3=CC=CC=C3C2=O)CCC(=O)OCC4=NC5=CC=CC=C5C6=CC=CC=C64

InChI

InChI=1S/C28H23N3O3/c32-27(16-15-26-30-24-12-6-4-10-22(24)28(33)31(26)18-13-14-18)34-17-25-21-9-2-1-7-19(21)20-8-3-5-11-23(20)29-25/h1-12,18H,13-17H2