4-azanyl-1-[6,6-dimethyl-4-(phenylmethoxymethyl)-2-bicyclo[3.1.0]hex-3-enyl]pyrimidin-2-one

Systemtic Name: 4-azanyl-1-[6,6-dimethyl-4-(phenylmethoxymethyl)-2-bicyclo[3.1.0]hex-3-enyl]pyrimidin-2-one Openeye Name: 4-amino-1-[4-(benzyloxymethyl)-6,6-dimethyl-2-bicyclo[3.1.0]hex-3-enyl]pyrimidin-2-one CAS Name: 4-amino-1-[6,6-dimethyl-4-(phenylmethoxymethyl)-2-bicyclo[3.1.0]hex-3-enyl]-2-pyrimidinone IUPAC Name: 4-amino-1-[6,6-dimethyl-4-(phenylmethoxymethyl)-2-bicyclo[3.1.0]hex-3-enyl]pyrimidin-2-one Traditional Name: 4-amino-1-[4-(benzoxymethyl)-6,6-dimethyl-2-bicyclo[3.1.0]hex-3-enyl]pyrimidin-2-one Formula: C20H23N3O2 MolecularWeight: 337.41552

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2C1C(=CC2N3C=CC(=NC3=O)N)COCC4=CC=CC=C4)C

Isomeric SMILES

CC1(C2C1C(=CC2N3C=CC(=NC3=O)N)COCC4=CC=CC=C4)C

InChI

InChI=1S/C20H23N3O2/c1-20(2)17-14(12-25-11-13-6-4-3-5-7-13)10-15(18(17)20)23-9-8-16(21)22-19(23)24/h3-10,15,17-18H,11-12H2,1-2H3,(H2,21,22,24)