2-acetyloxyethyl-[9-(2-carboxyphenyl)-6-[ethenyl(ethyl)amino]xanthen-3-ylidene]-ethyl-azanium

Systemtic Name: 2-acetyloxyethyl-[9-(2-carboxyphenyl)-6-[ethenyl(ethyl)amino]xanthen-3-ylidene]-ethyl-azanium Openeye Name: 2-acetoxyethyl-[9-(2-carboxyphenyl)-6-[ethyl(vinyl)amino]xanthen-3-ylidene]-ethyl-ammonium CAS Name: 2-acetyloxyethyl-[9-(2-carboxyphenyl)-6-[ethenyl(ethyl)amino]-3-xanthenylidene]-ethylammonium IUPAC Name: 2-acetyloxyethyl-[9-(2-carboxyphenyl)-6-[ethenyl(ethyl)amino]xanthen-3-ylidene]-ethylazanium Traditional Name: 2-acetoxyethyl-[9-(2-carboxyphenyl)-6-[ethyl(vinyl)amino]xanthen-3-ylidene]-ethyl-ammonium Formula: C30H31N2O5+ MolecularWeight: 499.57754

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C=C)C1=CC2=C(C=C1)C(=C3C=CC(=[N+](CC)CCOC(=O)C)C=C3O2)C4=CC=CC=C4C(=O)O

Isomeric SMILES

CCN(C=C)C1=CC2=C(C=C1)C(=C3C=CC(=[N+](CC)CCOC(=O)C)C=C3O2)C4=CC=CC=C4C(=O)O

InChI

InChI=1S/C30H30N2O5/c1-5-31(6-2)21-12-14-25-27(18-21)37-28-19-22(32(7-3)16-17-36-20(4)33)13-15-26(28)29(25)23-10-8-9-11-24(23)30(34)35/h5,8-15,18-19H,1,6-7,16-17H2,2-4H3/p+1