methyl 2-[8-(diethylamino)-12H-benzo[a]xanthen-11-yl]benzoate

Systemtic Name: methyl 2-[8-(diethylamino)-12H-benzo[a]xanthen-11-yl]benzoate Openeye Name: methyl 2-[8-(diethylamino)-12H-benzo[a]xanthen-11-yl]benzoate CAS Name: 2-[8-(diethylamino)-12H-benzo[a]xanthen-11-yl]benzoic acid methyl ester IUPAC Name: methyl 2-[8-(diethylamino)-12H-benzo[a]xanthen-11-yl]benzoate Traditional Name: 2-[8-(diethylamino)-12H-benzo[a]xanthen-11-yl]benzoic acid methyl ester Formula: C29H27NO3 MolecularWeight: 437.52958

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C2C(=C(C=C1)C3=CC=CC=C3C(=O)OC)CC4=C(O2)C=CC5=CC=CC=C45

Isomeric SMILES

CCN(CC)C1=C2C(=C(C=C1)C3=CC=CC=C3C(=O)OC)CC4=C(O2)C=CC5=CC=CC=C45

InChI

InChI=1S/C29H27NO3/c1-4-30(5-2)26-16-15-22(21-12-8-9-13-23(21)29(31)32-3)25-18-24-20-11-7-6-10-19(20)14-17-27(24)33-28(25)26/h6-17H,4-5,18H2,1-3H3