N-(3-azanylpropyl)-N-[1-[3-[(3-cyanophenyl)methyl]-7-methoxy-4-oxidanylidene-chromen-2-yl]-2-methyl-propyl]-3-fluoranyl-4-methyl-benzamide

Systemtic Name: N-(3-azanylpropyl)-N-[1-[3-[(3-cyanophenyl)methyl]-7-methoxy-4-oxidanylidene-chromen-2-yl]-2-methyl-propyl]-3-fluoranyl-4-methyl-benzamide Openeye Name: N-(3-aminopropyl)-N-[1-[3-[(3-cyanophenyl)methyl]-7-methoxy-4-oxo-chromen-2-yl]-2-methyl-propyl]-3-fluoro-4-methyl-benzamide CAS Name: N-(3-aminopropyl)-N-[1-[3-[(3-cyanophenyl)methyl]-7-methoxy-4-oxo-1-benzopyran-2-yl]-2-methylpropyl]-3-fluoro-4-methylbenzamide IUPAC Name: N-(3-aminopropyl)-N-[1-[3-[(3-cyanophenyl)methyl]-7-methoxy-4-oxochromen-2-yl]-2-methylpropyl]-3-fluoro-4-methylbenzamide Traditional Name: N-(3-aminopropyl)-N-[1-[3-(3-cyanobenzyl)-4-keto-7-methoxy-chromen-2-yl]-2-methyl-propyl]-3-fluoro-4-methyl-benzamide Formula: C33H34FN3O4 MolecularWeight: 555.639163

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N(CCCN)C(C2=C(C(=O)C3=C(O2)C=C(C=C3)OC)CC4=CC=CC(=C4)C#N)C(C)C)F

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N(CCCN)C(C2=C(C(=O)C3=C(O2)C=C(C=C3)OC)CC4=CC=CC(=C4)C#N)C(C)C)F

InChI

InChI=1S/C33H34FN3O4/c1-20(2)30(37(14-6-13-35)33(39)24-10-9-21(3)28(34)17-24)32-27(16-22-7-5-8-23(15-22)19-36)31(38)26-12-11-25(40-4)18-29(26)41-32/h5,7-12,15,17-18,20,30H,6,13-14,16,35H2,1-4H3