N'-[6-azanylidene-9-(1,3-benzodioxol-5-yl)xanthen-3-yl]-N'-ethyl-N,N-dimethyl-propane-1,3-diamine

Systemtic Name: N'-[6-azanylidene-9-(1,3-benzodioxol-5-yl)xanthen-3-yl]-N'-ethyl-N,N-dimethyl-propane-1,3-diamine Openeye Name: N'-[9-(1,3-benzodioxol-5-yl)-6-imino-xanthen-3-yl]-N'-ethyl-N,N-dimethyl-propane-1,3-diamine CAS Name: N'-[9-(1,3-benzodioxol-5-yl)-6-imino-3-xanthenyl]-N'-ethyl-N,N-dimethylpropane-1,3-diamine IUPAC Name: N'-[9-(1,3-benzodioxol-5-yl)-6-iminoxanthen-3-yl]-N'-ethyl-N,N-dimethylpropane-1,3-diamine Traditional Name: [9-(1,3-benzodioxol-5-yl)-6-imino-xanthen-3-yl]-[3-(dimethylamino)propyl]-ethyl-amine Formula: C27H29N3O3 MolecularWeight: 443.53746

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCN(C)C)C1=CC2=C(C=C1)C(=C3C=CC(=N)C=C3O2)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCN(CCCN(C)C)C1=CC2=C(C=C1)C(=C3C=CC(=N)C=C3O2)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C27H29N3O3/c1-4-30(13-5-12-29(2)3)20-8-10-22-25(16-20)33-24-15-19(28)7-9-21(24)27(22)18-6-11-23-26(14-18)32-17-31-23/h6-11,14-16,28H,4-5,12-13,17H2,1-3H3