3-phenyl-2-piperidin-1-ium-1-ylidene-4aH-quinazolin-4-one

Systemtic Name: 3-phenyl-2-piperidin-1-ium-1-ylidene-4aH-quinazolin-4-one Openeye Name: 3-phenyl-2-piperidin-1-ium-1-ylidene-4aH-quinazolin-4-one CAS Name: 3-phenyl-2-(1-piperidin-1-iumylidene)-4aH-quinazolin-4-one IUPAC Name: 3-phenyl-2-piperidin-1-ium-1-ylidene-4aH-quinazolin-4-one Traditional Name: 3-phenyl-2-piperidin-1-ium-1-ylidene-4aH-quinazolin-4-one Formula: C19H20N3O+ MolecularWeight: 306.3816

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[N+](=C2N=C3C=CC=CC3C(=O)N2C4=CC=CC=C4)CC1

Isomeric SMILES

C1CC[N+](=C2N=C3C=CC=CC3C(=O)N2C4=CC=CC=C4)CC1

InChI

InChI=1S/C19H20N3O/c23-18-16-11-5-6-12-17(16)20-19(21-13-7-2-8-14-21)22(18)15-9-3-1-4-10-15/h1,3-6,9-12,16H,2,7-8,13-14H2/q+1