[2-[[4-(azepan-1-yl)phenyl]amino]-2-oxidanylidene-ethyl]-bis(furan-2-ylmethyl)azanium

Systemtic Name: [2-[[4-(azepan-1-yl)phenyl]amino]-2-oxidanylidene-ethyl]-bis(furan-2-ylmethyl)azanium Openeye Name: [2-[4-(azepan-1-yl)anilino]-2-oxo-ethyl]-bis(2-furylmethyl)ammonium CAS Name: [2-[4-(1-azepanyl)anilino]-2-oxoethyl]-bis(2-furanylmethyl)ammonium IUPAC Name: [2-[4-(azepan-1-yl)anilino]-2-oxoethyl]-bis(furan-2-ylmethyl)azanium Traditional Name: [2-[4-(azepan-1-yl)anilino]-2-keto-ethyl]-bis(2-furfuryl)ammonium Formula: C24H30N3O3+ MolecularWeight: 408.5133

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC=C(C=C2)NC(=O)C[NH+](CC3=CC=CO3)CC4=CC=CO4

Isomeric SMILES

C1CCCN(CC1)C2=CC=C(C=C2)NC(=O)C[NH+](CC3=CC=CO3)CC4=CC=CO4

InChI

InChI=1S/C24H29N3O3/c28-24(19-26(17-22-7-5-15-29-22)18-23-8-6-16-30-23)25-20-9-11-21(12-10-20)27-13-3-1-2-4-14-27/h5-12,15-16H,1-4,13-14,17-19H2,(H,25,28)/p+1