1-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-3-(furan-2-ylmethyl)quinazoline-2,4-dione

Systemtic Name: 1-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-3-(furan-2-ylmethyl)quinazoline-2,4-dione Openeye Name: 1-[2-(azepan-1-yl)-2-oxo-ethyl]-3-(2-furylmethyl)quinazoline-2,4-dione CAS Name: 1-[2-(1-azepanyl)-2-oxoethyl]-3-(2-furanylmethyl)quinazoline-2,4-dione IUPAC Name: 1-[2-(azepan-1-yl)-2-oxoethyl]-3-(furan-2-ylmethyl)quinazoline-2,4-dione Traditional Name: 1-[2-(azepan-1-yl)-2-keto-ethyl]-3-(2-furfuryl)quinazoline-2,4-quinone Formula: C21H23N3O4 MolecularWeight: 381.42502

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CN2C3=CC=CC=C3C(=O)N(C2=O)CC4=CC=CO4

Isomeric SMILES

C1CCCN(CC1)C(=O)CN2C3=CC=CC=C3C(=O)N(C2=O)CC4=CC=CO4

InChI

InChI=1S/C21H23N3O4/c25-19(22-11-5-1-2-6-12-22)15-23-18-10-4-3-9-17(18)20(26)24(21(23)27)14-16-8-7-13-28-16/h3-4,7-10,13H,1-2,5-6,11-12,14-15H2