1-(2,3-dihydroindol-1-yl)-4-[4-(furan-2-ylmethyl)-1,4-diazepan-1-yl]butane-1,4-dione

Systemtic Name: 1-(2,3-dihydroindol-1-yl)-4-[4-(furan-2-ylmethyl)-1,4-diazepan-1-yl]butane-1,4-dione Openeye Name: 1-[4-(2-furylmethyl)-1,4-diazepan-1-yl]-4-indolin-1-yl-butane-1,4-dione CAS Name: 1-(2,3-dihydroindol-1-yl)-4-[4-(2-furanylmethyl)-1,4-diazepan-1-yl]butane-1,4-dione IUPAC Name: 1-(2,3-dihydroindol-1-yl)-4-[4-(furan-2-ylmethyl)-1,4-diazepan-1-yl]butane-1,4-dione Traditional Name: 1-[4-(2-furfuryl)-1,4-diazepan-1-yl]-4-indolin-1-yl-butane-1,4-dione Formula: C22H27N3O3 MolecularWeight: 381.46808

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)CCC(=O)N2CCC3=CC=CC=C32)CC4=CC=CO4

Isomeric SMILES

C1CN(CCN(C1)C(=O)CCC(=O)N2CCC3=CC=CC=C32)CC4=CC=CO4

InChI

InChI=1S/C22H27N3O3/c26-21(8-9-22(27)25-13-10-18-5-1-2-7-20(18)25)24-12-4-11-23(14-15-24)17-19-6-3-16-28-19/h1-3,5-7,16H,4,8-15,17H2