2-azanyl-3-(1H-benzimidazol-2-yl)-5,6,8,8a-tetrahydrochromen-7-one

Systemtic Name: 2-azanyl-3-(1H-benzimidazol-2-yl)-5,6,8,8a-tetrahydrochromen-7-one Openeye Name: 2-amino-3-(1H-benzimidazol-2-yl)-5,6,8,8a-tetrahydrochromen-7-one CAS Name: 2-amino-3-(1H-benzimidazol-2-yl)-5,6,8,8a-tetrahydro-1-benzopyran-7-one IUPAC Name: 2-amino-3-(1H-benzimidazol-2-yl)-5,6,8,8a-tetrahydrochromen-7-one Traditional Name: 2-amino-3-(1H-benzimidazol-2-yl)-5,6,8,8a-tetrahydrochromen-7-one Formula: C16H15N3O2 MolecularWeight: 281.3092

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC(=C(OC2CC1=O)N)C3=NC4=CC=CC=C4N3

Isomeric SMILES

C1CC2=CC(=C(OC2CC1=O)N)C3=NC4=CC=CC=C4N3

InChI

InChI=1S/C16H15N3O2/c17-15-11(7-9-5-6-10(20)8-14(9)21-15)16-18-12-3-1-2-4-13(12)19-16/h1-4,7,14H,5-6,8,17H2,(H,18,19)