4-[3-[(2S)-2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-3-oxidanylidene-propyl]-1,4-benzoxazin-3-one

Systemtic Name: 4-[3-[(2S)-2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-3-oxidanylidene-propyl]-1,4-benzoxazin-3-one Openeye Name: 4-[3-[(2S)-2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-3-oxo-propyl]-1,4-benzoxazin-3-one CAS Name: 4-[3-[(2S)-2-(1H-benzimidazol-2-yl)-1-pyrrolidinyl]-3-oxopropyl]-1,4-benzoxazin-3-one IUPAC Name: 4-[3-[(2S)-2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-3-oxopropyl]-1,4-benzoxazin-3-one Traditional Name: 4-[3-[(2S)-2-(1H-benzimidazol-2-yl)pyrrolidino]-3-keto-propyl]-1,4-benzoxazin-3-one Formula: C22H22N4O3 MolecularWeight: 390.43508

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CCN2C(=O)COC3=CC=CC=C32)C4=NC5=CC=CC=C5N4

Isomeric SMILES

C1C[C@H](N(C1)C(=O)CCN2C(=O)COC3=CC=CC=C32)C4=NC5=CC=CC=C5N4

InChI

InChI=1S/C22H22N4O3/c27-20(11-13-26-17-8-3-4-10-19(17)29-14-21(26)28)25-12-5-9-18(25)22-23-15-6-1-2-7-16(15)24-22/h1-4,6-8,10,18H,5,9,11-14H2,(H,23,24)/t18-/m0/s1