3-azanyl-2-[(1S)-1-[(E)-3-phenylprop-2-enoxy]ethyl]-4aH-quinazolin-3-ium-4-one

Systemtic Name: 3-azanyl-2-[(1S)-1-[(E)-3-phenylprop-2-enoxy]ethyl]-4aH-quinazolin-3-ium-4-one Openeye Name: 3-amino-2-[(1S)-1-[(E)-cinnamyl]oxyethyl]-4aH-quinazolin-3-ium-4-one CAS Name: 3-amino-2-[(1S)-1-[(E)-3-phenylprop-2-enoxy]ethyl]-4aH-quinazolin-3-ium-4-one IUPAC Name: 3-amino-2-[(1S)-1-[(E)-3-phenylprop-2-enoxy]ethyl]-4aH-quinazolin-3-ium-4-one Traditional Name: 3-amino-2-[(1S)-1-[(E)-cinnamyl]oxyethyl]-4aH-quinazolin-3-ium-4-one Formula: C19H20N3O2+ MolecularWeight: 322.381

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=[N+](C(=O)C2C=CC=CC2=N1)N)OCC=CC3=CC=CC=C3

Isomeric SMILES

C[C@@H](C1=[N+](C(=O)C2C=CC=CC2=N1)N)OC/C=C/C3=CC=CC=C3

InChI

InChI=1S/C19H20N3O2/c1-14(24-13-7-10-15-8-3-2-4-9-15)18-21-17-12-6-5-11-16(17)19(23)22(18)20/h2-12,14,16H,13,20H2,1H3/q+1/b10-7+/t14-,16?/m0/s1