N-(3-azanylpropyl)-N-[1-[7-fluoranyl-4-oxidanylidene-3-(phenylmethyl)chromen-2-yl]-2-methyl-propyl]-1-methyl-pyrrole-2-carboxamide

Systemtic Name: N-(3-azanylpropyl)-N-[1-[7-fluoranyl-4-oxidanylidene-3-(phenylmethyl)chromen-2-yl]-2-methyl-propyl]-1-methyl-pyrrole-2-carboxamide Openeye Name: N-(3-aminopropyl)-N-[1-(3-benzyl-7-fluoro-4-oxo-chromen-2-yl)-2-methyl-propyl]-1-methyl-pyrrole-2-carboxamide CAS Name: N-(3-aminopropyl)-N-[1-[7-fluoro-4-oxo-3-(phenylmethyl)-1-benzopyran-2-yl]-2-methylpropyl]-1-methyl-2-pyrrolecarboxamide IUPAC Name: N-(3-aminopropyl)-N-[1-(3-benzyl-7-fluoro-4-oxochromen-2-yl)-2-methylpropyl]-1-methylpyrrole-2-carboxamide Traditional Name: N-(3-aminopropyl)-N-[1-(3-benzyl-7-fluoro-4-keto-chromen-2-yl)-2-methyl-propyl]-1-methyl-pyrrole-2-carboxamide Formula: C29H32FN3O3 MolecularWeight: 489.581083

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=C(C(=O)C2=C(O1)C=C(C=C2)F)CC3=CC=CC=C3)N(CCCN)C(=O)C4=CC=CN4C

Isomeric SMILES

CC(C)C(C1=C(C(=O)C2=C(O1)C=C(C=C2)F)CC3=CC=CC=C3)N(CCCN)C(=O)C4=CC=CN4C

InChI

InChI=1S/C29H32FN3O3/c1-19(2)26(33(16-8-14-31)29(35)24-11-7-15-32(24)3)28-23(17-20-9-5-4-6-10-20)27(34)22-13-12-21(30)18-25(22)36-28/h4-7,9-13,15,18-19,26H,8,14,16-17,31H2,1-3H3