heptyl 2-[10-(3-bromanylpropyl)-5,6-dimethyl-9-oxidanylidene-acridin-1-yl]propanoate

Systemtic Name: heptyl 2-[10-(3-bromanylpropyl)-5,6-dimethyl-9-oxidanylidene-acridin-1-yl]propanoate Openeye Name: heptyl 2-[10-(3-bromopropyl)-5,6-dimethyl-9-oxo-acridin-1-yl]propanoate CAS Name: 2-[10-(3-bromopropyl)-5,6-dimethyl-9-oxo-1-acridinyl]propanoic acid heptyl ester IUPAC Name: heptyl 2-[10-(3-bromopropyl)-5,6-dimethyl-9-oxoacridin-1-yl]propanoate Traditional Name: 2-[10-(3-bromopropyl)-9-keto-5,6-dimethyl-acridin-1-yl]propionic acid heptyl ester Formula: C28H36BrNO3 MolecularWeight: 514.49434

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=O)C(C)C1=C2C(=CC=C1)N(C3=C(C2=O)C=CC(=C3C)C)CCCBr

Isomeric SMILES

CCCCCCCOC(=O)C(C)C1=C2C(=CC=C1)N(C3=C(C2=O)C=CC(=C3C)C)CCCBr

InChI

InChI=1S/C28H36BrNO3/c1-5-6-7-8-9-18-33-28(32)21(4)22-12-10-13-24-25(22)27(31)23-15-14-19(2)20(3)26(23)30(24)17-11-16-29/h10,12-15,21H,5-9,11,16-18H2,1-4H3